Monday, November 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 9H-fluoren-9-ylmethyl N-[(1R)-5-(tert-butoxycarbonylamino)-1-[2-[[4-[2-[[(2R)-6-(tert-butoxycarbonylamino)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoyl]amino]ethylamino]-9,10-dioxo-1-anthryl]amino]ethylcarbamoyl]pentyl]carbamate
CAS Name: N-[(5R)-5-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-6-[2-[[4-[2-[[(2R)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]ethylamino]-9,10-dioxo-1-anthracenyl]amino]ethylamino]-6-oxohexyl]carbamic
IUPAC NAME: tert-butyl N-[(5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[2-[[4-[2-[[(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethylamino]-6-oxohexyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(5R)-5-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[2-[[4-[2-[[(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]ethylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]amino]ethylamino]-6-oxidanylide
MOLECULAR FORMULA: C70H80N8O12
MOLECULAR WEIGHT: 1225.4306
SMILES: CC(C)(C)OC(=O)NCCCC[C@H](C(=O)NCCNC1=C2C(=C(C=C1)NCCNC(=O)[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)C6=CC=CC=C6C2=O)NC(=O)OCC7C8=CC=CC=C8C9=CC=CC=C79
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Product OPENEYE NAME: tert-butyl N-[(5R)-5-amino-6-[2-[[4-[2-[[(2R)-2-amino-6-(tert-butoxycarbonylamino)hexanoyl]amino]ethylamino]-9,10-dioxo-1-anthryl]amino]ethylamino]-6-oxo-hexyl]carbamate
CAS Name: N-[(5R)-5-amino-6-[2-[[4-[2-[[(2R)-2-amino-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]amino]ethylamino]-9,10-dioxo-1-anthracenyl]amino]ethylamino]-6-oxohexyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[(5R)-5-amino-6-[2-[[4-[2-[[(2R)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]ethylamino]-9,10-dioxoanthracen-1-yl]amino]ethylamino]-6-oxohexyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(5R)-5-azanyl-6-[2-[[4-[2-[[(2R)-2-azanyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]amino]ethylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]amino]ethylamino]-6-oxidanylidene-hexyl]carbamate
MOLECULAR FORMULA: C40H60N8O8
MOLECULAR WEIGHT: 780.9532
SMILES: CC(C)(C)OC(=O)NCCCC[C@H](C(=O)NCCNC1=C2C(=C(C=C1)NCCNC(=O)[C@@H](CCCCNC(=O)OC(C)(C)C)N)C(=O)C3=CC=CC=C3C2=O)N
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Product OPENEYE NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-guanidino-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-guanidino-2-(pentanoylamino)pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methyl-pentanoyl]amino]hexanamide
CAS Name: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-oxo-2-(1-oxopentylamino)pentyl]amino]-1-oxo-3-phenylpropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopentyl]amino]-3-methyl-1-o
IUPAC NAME: (2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-(pentanoylamino)pentanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methylpentanoyl]amino]he
SYSTEMATIC NAME: (2S)-6-azanyl-2-[[(2S,3S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-(pentanoylamino)pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]pentanoyl]amino]-3-methyl-pentano
MOLECULAR FORMULA: C47H76N14O8
MOLECULAR WEIGHT: 965.19534
SMILES: CCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N
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Product OPENEYE NAME: (2S)-2-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-tetrahydropyran-4-yl-pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]propanamide
CAS Name: (2S)-2-amino-N-[(1S)-1-[2-[4-[[(3S,4R)-4-(4-chlorophenyl)-1-(4-oxanyl)-3-pyrrolidinyl]-oxomethyl]-1-piperazinyl]-5-methylphenyl]-2-methylpropyl]propanamide
IUPAC NAME: (2S)-2-amino-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidine-3-carbonyl]piperazin-1-yl]-5-methylphenyl]-2-methylpropyl]propanamide
SYSTEMATIC NAME: (2S)-2-azanyl-N-[(1S)-1-[2-[4-[(3S,4R)-4-(4-chlorophenyl)-1-(oxan-4-yl)pyrrolidin-3-yl]carbonylpiperazin-1-yl]-5-methyl-phenyl]-2-methyl-propyl]propanamide
MOLECULAR FORMULA: C34H48ClN5O3
MOLECULAR WEIGHT: 610.22962
SMILES: CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)[C@@H]3CN(C[C@H]3C4=CC=C(C=C4)Cl)C5CCOCC5)[C@H](C(C)C)NC(=O)[C@H](C)N
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Product OPENEYE NAME: 4-(4-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
CAS Name: 4-(4-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 4-(4-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 4-(4-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C18H18N2O5
MOLECULAR WEIGHT: 342.34592
SMILES: COC1=CC(=CC(=C1OC)OC)N2C(=CNC2=O)C3=CC=C(C=C3)O
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Product OPENEYE NAME: 3-[5-(imidazol-1-ylmethyl)-2-pyridyl]aniline
CAS Name: 3-[5-(1-imidazolylmethyl)-2-pyridinyl]aniline
IUPAC NAME: 3-[5-(imidazol-1-ylmethyl)pyridin-2-yl]aniline
SYSTEMATIC NAME: 3-[5-(imidazol-1-ylmethyl)pyridin-2-yl]aniline
MOLECULAR FORMULA: C15H14N4
MOLECULAR WEIGHT: 250.29846
SMILES: C1=CC(=CC(=C1)N)C2=NC=C(C=C2)CN3C=CN=C3
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Product OPENEYE NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-9-(1-methoxy-1-methyl-ethoxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
CAS Name: (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furanyl)-9-(2-methoxypropan-2-yloxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f][2]benzopyran-7-carboxylic acid methyl ester
IUPAC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-(2-methoxypropan-2-yloxy)-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
SYSTEMATIC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-(2-methoxypropan-2-yloxy)-6a,10b-dimethyl-4,10-bis(oxidanylidene)-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
MOLECULAR FORMULA: C25H34O8
MOLECULAR WEIGHT: 462.53266
SMILES: C[C@@]12CC[C@H]3C(=O)O[C@@H](C[C@@]3([C@H]1C(=O)[C@H](C[C@H]2C(=O)OC)OC(C)(C)OC)C)C4=COC=C4
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Product OPENEYE NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furyl)-6a,10b-dimethyl-4,10-dioxo-9-tetrahydropyran-2-yloxy-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
CAS Name: (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(3-furanyl)-6a,10b-dimethyl-9-(2-oxanyloxy)-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f][2]benzopyran-7-carboxylic acid methyl ester
IUPAC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-9-(oxan-2-yloxy)-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
SYSTEMATIC NAME: methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-6a,10b-dimethyl-9-(oxan-2-yloxy)-4,10-bis(oxidanylidene)-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
MOLECULAR FORMULA: C26H34O8
MOLECULAR WEIGHT: 474.54336
SMILES: C[C@@]12CC[C@H]3C(=O)O[C@@H](C[C@@]3([C@H]1C(=O)[C@H](C[C@H]2C(=O)OC)OC4CCCCO4)C)C5=COC=C5
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Product OPENEYE NAME: (5R)-3-dibenzo-p-dioxin-2-yl-5-(triazol-1-ylmethyl)oxazolidin-2-one
CAS Name: (5R)-3-(2-dibenzo-p-dioxinyl)-5-(1-triazolylmethyl)-2-oxazolidinone
IUPAC NAME: (5R)-3-dibenzo-p-dioxin-2-yl-5-(triazol-1-ylmethyl)-1,3-oxazolidin-2-one
SYSTEMATIC NAME: (5R)-3-dibenzo-p-dioxin-2-yl-5-(1,2,3-triazol-1-ylmethyl)-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C18H14N4O4
MOLECULAR WEIGHT: 350.32816
SMILES: C1[C@@H](OC(=O)N1C2=CC3=C(C=C2)OC4=CC=CC=C4O3)CN5C=CN=N5
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Product OPENEYE NAME: (2R)-N-(2-hydroxyethyl)-2-[(2R,5R)-5-indan-2-yl-2-isobutyl-3,6-dioxo-piperazin-1-yl]-N-methyl-2-(2-methyloxazol-4-yl)acetamide
CAS Name: (2R)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxo-1-piperazinyl]-N-(2-hydroxyethyl)-N-methyl-2-(2-methyl-4-oxazolyl)acetamide
IUPAC NAME: (2R)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxopiperazin-1-yl]-N-(2-hydroxyethyl)-N-methyl-2-(2-methyl-1,3-oxazol-4-yl)acetamide
SYSTEMATIC NAME: (2R)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-bis(oxidanylidene)piperazin-1-yl]-N-(2-hydroxyethyl)-N-methyl-2-(2-methyl-1,3-oxazol-4-yl)ethanamide
MOLECULAR FORMULA: C26H34N4O5
MOLECULAR WEIGHT: 482.57196
SMILES: CC1=NC(=CO1)[C@H](C(=O)N(C)CCO)N2[C@@H](C(=O)N[C@@H](C2=O)C3CC4=CC=CC=C4C3)CC(C)C
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Product OPENEYE NAME: bis[[(3S,4S)-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]methyl] hexanedioate
CAS Name: hexanedioic acid bis[[(3S,4S)-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]methyl] ester
IUPAC NAME: bis[[(3S,4S)-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]methyl] hexanedioate
SYSTEMATIC NAME: bis[[(3S,4S)-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]methyl] hexanedioate
MOLECULAR FORMULA: C36H44Cl4N2O4
MOLECULAR WEIGHT: 710.55756
SMILES: CN1C2CCC1[C@H]([C@H](C2)C3=CC(=C(C=C3)Cl)Cl)COC(=O)CCCCC(=O)OC[C@H]4[C@H](CC5CCC4N5C)C6=CC(=C(C=C6)Cl)Cl
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Product OPENEYE NAME: N-(2-cyclohexylethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
CAS Name: N-(2-cyclohexylethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
IUPAC NAME: N-(2-cyclohexylethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
SYSTEMATIC NAME: N-(2-cyclohexylethyl)-4-methyl-1,4-dihydroquinazolin-2-amine
MOLECULAR FORMULA: C17H25N3
MOLECULAR WEIGHT: 271.4005
SMILES: CC1C2=CC=CC=C2NC(=N1)NCCC3CCCCC3
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Product OPENEYE NAME: 1-[2-[2-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]ethyl]piperidine
CAS Name: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]piperidine
IUPAC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]piperidine
SYSTEMATIC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]piperidine
MOLECULAR FORMULA: C25H29NO2S
MOLECULAR WEIGHT: 407.56826
SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2OCCN3CCCCC3)C4=CC=CS4
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Product OPENEYE NAME: 1-[2-[2-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]ethyl]azepane
CAS Name: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]azepane
IUPAC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]azepane
SYSTEMATIC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]azepane
MOLECULAR FORMULA: C26H31NO2S
MOLECULAR WEIGHT: 421.59484
SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2OCCN3CCCCCC3)C4=CC=CS4
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Product OPENEYE NAME: N,N-diethyl-2-[2-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]ethanamine
CAS Name: N,N-diethyl-2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethanamine
IUPAC NAME: N,N-diethyl-2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethanamine
SYSTEMATIC NAME: N,N-diethyl-2-[2-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]ethanamine
MOLECULAR FORMULA: C24H29NO2S
MOLECULAR WEIGHT: 395.55756
SMILES: CCN(CC)CCOC1=CC=CC=C1C(C2=CC=C(C=C2)OC)C3=CC=CS3
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Product OPENEYE NAME: 1-[2-[2-[(4-methoxyphenyl)-(2-thienyl)methyl]phenoxy]ethyl]pyrrolidine
CAS Name: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]pyrrolidine
IUPAC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]phenoxy]ethyl]pyrrolidine
SYSTEMATIC NAME: 1-[2-[2-[(4-methoxyphenyl)-thiophen-2-yl-methyl]phenoxy]ethyl]pyrrolidine
MOLECULAR FORMULA: C24H27NO2S
MOLECULAR WEIGHT: 393.54168
SMILES: COC1=CC=C(C=C1)C(C2=CC=CC=C2OCCN3CCCC3)C4=CC=CS4
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Product OPENEYE NAME: sodium 1-amino-4-(2-ethoxyanilino)-9,10-dioxo-anthracene-2-sulfonate
CAS Name: sodium 1-amino-4-(2-ethoxyanilino)-9,10-dioxo-2-anthracenesulfonate
IUPAC NAME: sodium 1-amino-4-(2-ethoxyanilino)-9,10-dioxoanthracene-2-sulfonate
SYSTEMATIC NAME: sodium 1-azanyl-4-[(2-ethoxyphenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonate
MOLECULAR FORMULA: C22H17N2NaO6S
MOLECULAR WEIGHT: 460.43495
SMILES: CCOC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]
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Product OPENEYE NAME: 1-amino-4-(2-ethoxyanilino)-9,10-dioxo-anthracene-2-sulfonic acid
CAS Name: 1-amino-4-(2-ethoxyanilino)-9,10-dioxo-2-anthracenesulfonic acid
IUPAC NAME: 1-amino-4-(2-ethoxyanilino)-9,10-dioxoanthracene-2-sulfonic acid
SYSTEMATIC NAME: 1-azanyl-4-[(2-ethoxyphenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid
MOLECULAR FORMULA: C22H18N2O6S
MOLECULAR WEIGHT: 438.45312
SMILES: CCOC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O
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Product OPENEYE NAME: (E)-2-(5-chloro-2-thienyl)-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]prop-1-ene-1-sulfonamide
CAS Name: (E)-2-(5-chloro-2-thiophenyl)-N-[1-[4-[2-[(dimethylamino)methyl]-1-imidazolyl]-2-fluorophenyl]-2-oxo-3-pyrrolidinyl]-1-propene-1-sulfonamide
IUPAC NAME: (E)-2-(5-chlorothiophen-2-yl)-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluorophenyl]-2-oxopyrrolidin-3-yl]prop-1-ene-1-sulfonamide
SYSTEMATIC NAME: (E)-2-(5-chloranylthiophen-2-yl)-N-[1-[4-[2-[(dimethylamino)methyl]imidazol-1-yl]-2-fluoranyl-phenyl]-2-oxidanylidene-pyrrolidin-3-yl]prop-1-ene-1-sulfonamide
MOLECULAR FORMULA: C23H25ClFN5O3S2
MOLECULAR WEIGHT: 538.057703
SMILES: C/C(=C\S(=O)(=O)NC1CCN(C1=O)C2=C(C=C(C=C2)N3C=CN=C3CN(C)C)F)/C4=CC=C(S4)Cl
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Product OPENEYE NAME: 2-(4-fluorophenyl)-5-(1-naphthyl)-3-phenyl-tetrazol-2-ium chloride
CAS Name: 2-(4-fluorophenyl)-5-(1-naphthalenyl)-3-phenyltetrazol-2-ium chloride
IUPAC NAME: 2-(4-fluorophenyl)-5-naphthalen-1-yl-3-phenyltetrazol-2-ium chloride
SYSTEMATIC NAME: 2-(4-fluorophenyl)-5-naphthalen-1-yl-3-phenyl-1,2,3,4-tetrazol-2-ium chloride
MOLECULAR FORMULA: C23H16ClFN4
MOLECULAR WEIGHT: 402.851343
SMILES: C1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=C(C=C3)F)C4=CC=CC5=CC=CC=C54.[Cl-]
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Product OPENEYE NAME: 2-(4-fluorophenyl)-5-(1-naphthyl)-3-phenyl-tetrazol-2-ium
CAS Name: 2-(4-fluorophenyl)-5-(1-naphthalenyl)-3-phenyltetrazol-2-ium
IUPAC NAME: 2-(4-fluorophenyl)-5-naphthalen-1-yl-3-phenyltetrazol-2-ium
SYSTEMATIC NAME: 2-(4-fluorophenyl)-5-naphthalen-1-yl-3-phenyl-1,2,3,4-tetrazol-2-ium
MOLECULAR FORMULA: C23H16FN4+
MOLECULAR WEIGHT: 367.398343
SMILES: C1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=C(C=C3)F)C4=CC=CC5=CC=CC=C54
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Product OPENEYE NAME: 2-(2-fluorophenyl)-3,5-diphenyl-tetrazol-2-ium chloride
CAS Name: 2-(2-fluorophenyl)-3,5-diphenyltetrazol-2-ium chloride
IUPAC NAME: 2-(2-fluorophenyl)-3,5-diphenyltetrazol-2-ium chloride
SYSTEMATIC NAME: 2-(2-fluorophenyl)-3,5-diphenyl-1,2,3,4-tetrazol-2-ium chloride
MOLECULAR FORMULA: C19H14ClFN4
MOLECULAR WEIGHT: 352.792663
SMILES: C1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=CC=C3F)C4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: 2-(2-fluorophenyl)-3,5-diphenyl-tetrazol-2-ium
CAS Name: 2-(2-fluorophenyl)-3,5-diphenyltetrazol-2-ium
IUPAC NAME: 2-(2-fluorophenyl)-3,5-diphenyltetrazol-2-ium
SYSTEMATIC NAME: 2-(2-fluorophenyl)-3,5-diphenyl-1,2,3,4-tetrazol-2-ium
MOLECULAR FORMULA: C19H14FN4+
MOLECULAR WEIGHT: 317.339663
SMILES: C1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=CC=C3F)C4=CC=CC=C4
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Product OPENEYE NAME: 2-(4-fluorophenyl)-3-(4-methoxyphenyl)-5-(4-phenylphenyl)tetrazol-2-ium chloride
CAS Name: 2-(4-fluorophenyl)-3-(4-methoxyphenyl)-5-(4-phenylphenyl)tetrazol-2-ium chloride
IUPAC NAME: 2-(4-fluorophenyl)-3-(4-methoxyphenyl)-5-(4-phenylphenyl)tetrazol-2-ium chloride
SYSTEMATIC NAME: 2-(4-fluorophenyl)-3-(4-methoxyphenyl)-5-(4-phenylphenyl)-1,2,3,4-tetrazol-2-ium chloride
MOLECULAR FORMULA: C26H20ClFN4O
MOLECULAR WEIGHT: 458.914603
SMILES: COC1=CC=C(C=C1)N2N=C(N=[N+]2C3=CC=C(C=C3)F)C4=CC=C(C=C4)C5=CC=CC=C5.[Cl-]
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