Product OPENEYE NAME: tert-butyl (2S,3S,4R)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-2-(hydroxymethyl)-4-phenyl-pyrrolidine-1-carboxylate
CAS Name: (2S,3S,4R)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-2-(hydroxymethyl)-4-phenyl-1-pyrrolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl (2S,3S,4R)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-2-(hydroxymethyl)-4-phenylpyrrolidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl (2S,3S,4R)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-2-(hydroxymethyl)-4-phenyl-pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C26H29F6NO4
MOLECULAR WEIGHT: 533.503179
SMILES: C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@H]2[C@@H](CN([C@H]2CO)C(=O)OC(C)(C)C)C3=CC=CC=C3
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Product OPENEYE NAME: tert-butyl (2S,3S,4R)-3-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CAS Name: (2S,3S,4R)-3-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl (2S,3S,4R)-3-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl (2S,3S,4R)-3-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C26H28F7NO4
MOLECULAR WEIGHT: 551.493642
SMILES: C[C@@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@H]2[C@@H](CN([C@H]2CO)C(=O)OC(C)(C)C)C3=CC=C(C=C3)F
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Product OPENEYE NAME: N-[2-(4-chlorophenyl)ethyl]-6-hydroxy-naphthalene-2-carboxamide
CAS Name: N-[2-(4-chlorophenyl)ethyl]-6-hydroxy-2-naphthalenecarboxamide
IUPAC NAME: N-[2-(4-chlorophenyl)ethyl]-6-hydroxynaphthalene-2-carboxamide
SYSTEMATIC NAME: N-[2-(4-chlorophenyl)ethyl]-6-oxidanyl-naphthalene-2-carboxamide
MOLECULAR FORMULA: C19H16ClNO2
MOLECULAR WEIGHT: 325.78884
SMILES: C1=CC(=CC=C1CCNC(=O)C2=CC3=C(C=C2)C=C(C=C3)O)Cl
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Product OPENEYE NAME: 3-(6-chlorobenzothiophen-2-yl)sulfonyl-N-methyl-N-[1-(2-methyl-4-pyridyl)-4-piperidyl]propanamide
CAS Name: 3-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-N-methyl-N-[1-(2-methyl-4-pyridinyl)-4-piperidinyl]propanamide
IUPAC NAME: 3-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-N-methyl-N-[1-(2-methylpyridin-4-yl)piperidin-4-yl]propanamide
SYSTEMATIC NAME: 3-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-N-methyl-N-[1-(2-methylpyridin-4-yl)piperidin-4-yl]propanamide
MOLECULAR FORMULA: C23H26ClN3O3S2
MOLECULAR WEIGHT: 492.05384
SMILES: CC1=NC=CC(=C1)N2CCC(CC2)N(C)C(=O)CCS(=O)(=O)C3=CC4=C(S3)C=C(C=C4)Cl
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Product OPENEYE NAME: N-[2-(4-chlorophenyl)ethyl]-6-hydroxy-tetralin-2-carboxamide
CAS Name: N-[2-(4-chlorophenyl)ethyl]-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxamide
IUPAC NAME: N-[2-(4-chlorophenyl)ethyl]-6-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxamide
SYSTEMATIC NAME: N-[2-(4-chlorophenyl)ethyl]-6-oxidanyl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
MOLECULAR FORMULA: C19H20ClNO2
MOLECULAR WEIGHT: 329.8206
SMILES: C1CC2=C(CC1C(=O)NCCC3=CC=C(C=C3)Cl)C=CC(=C2)O
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Product OPENEYE NAME: 1,3-bis[(4-chlorophenyl)methyl]imidazolidine
CAS Name: 1,3-bis[(4-chlorophenyl)methyl]imidazolidine
IUPAC NAME: 1,3-bis[(4-chlorophenyl)methyl]imidazolidine
SYSTEMATIC NAME: 1,3-bis[(4-chlorophenyl)methyl]imidazolidine
MOLECULAR FORMULA: C17H18Cl2N2
MOLECULAR WEIGHT: 321.24422
SMILES: C1CN(CN1CC2=CC=C(C=C2)Cl)CC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-[3-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]-2-thienyl]phenyl]ethanone
CAS Name: 1-[3-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]-2-thiophenyl]phenyl]ethanone
IUPAC NAME: 1-[3-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]ethanone
SYSTEMATIC NAME: 1-[3-[5-azanyl-4-(phenylcarbonyl)-3-[3-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]ethanone
MOLECULAR FORMULA: C26H18F3NO2S
MOLECULAR WEIGHT: 465.48683
SMILES: CC(=O)C1=CC=CC(=C1)C2=C(C(=C(S2)N)C(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F
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Product OPENEYE NAME: 1-[4-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]-2-thienyl]phenyl]ethanone
CAS Name: 1-[4-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]-2-thiophenyl]phenyl]ethanone
IUPAC NAME: 1-[4-[5-amino-4-benzoyl-3-[3-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]ethanone
SYSTEMATIC NAME: 1-[4-[5-azanyl-4-(phenylcarbonyl)-3-[3-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]ethanone
MOLECULAR FORMULA: C26H18F3NO2S
MOLECULAR WEIGHT: 465.48683
SMILES: CC(=O)C1=CC=C(C=C1)C2=C(C(=C(S2)N)C(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C(F)(F)F
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Product OPENEYE NAME: 2-bromo-3-[(5Z)-5-(5-methyl-3H-1,3,4-oxadiazol-2-ylidene)-6-propyl-1,4-dihydropyrazolo[3,4-b]pyridin-4-yl]benzonitrile
CAS Name: 2-bromo-3-[(5Z)-5-(5-methyl-3H-1,3,4-oxadiazol-2-ylidene)-6-propyl-1,4-dihydropyrazolo[3,4-b]pyridin-4-yl]benzonitrile
IUPAC NAME: 2-bromo-3-[(5Z)-5-(5-methyl-3H-1,3,4-oxadiazol-2-ylidene)-6-propyl-1,4-dihydropyrazolo[3,4-b]pyridin-4-yl]benzonitrile
SYSTEMATIC NAME: 2-bromanyl-3-[(5Z)-5-(5-methyl-3H-1,3,4-oxadiazol-2-ylidene)-6-propyl-1,4-dihydropyrazolo[3,4-b]pyridin-4-yl]benzenecarbonitrile
MOLECULAR FORMULA: C19H17BrN6O
MOLECULAR WEIGHT: 425.28188
SMILES: CCCC\1=NC2=C(C=NN2)C(/C1=C/3\NN=C(O3)C)C4=CC=CC(=C4Br)C#N
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Product OPENEYE NAME: 6-(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-4-[6-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-1,2-dihydropyridazin-3-one
CAS Name: 6-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)-4-[6-[(4-methyl-1-piperazinyl)methyl]-1H-benzimidazol-2-yl]-1,2-dihydropyridazin-3-one
IUPAC NAME: 6-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-[6-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-1,2-dihydropyridazin-3-one
SYSTEMATIC NAME: 6-(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-[6-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-1,2-dihydropyridazin-3-one
MOLECULAR FORMULA: C25H28N6O2
MOLECULAR WEIGHT: 444.52882
SMILES: CC1=CC(=C2C=C(C(=O)NN2)C3=NC4=C(N3)C=C(C=C4)CN5CCN(CC5)C)C=C(C1=O)C
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Product OPENEYE NAME: 1-[(2R,3R,4S)-3-hydroxy-2-tetradecyl-4-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]azetidin-1-yl]hexacosan-1-one
CAS Name: 1-[(2R,3R,4S)-3-hydroxy-2-tetradecyl-4-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-1-azetidinyl]-1-hexacosanone
IUPAC NAME: 1-[(2R,3R,4S)-3-hydroxy-2-tetradecyl-4-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]azetidin-1-yl]hexacosan-1-one
SYSTEMATIC NAME: 1-[(2S,3R,4R)-2-[[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3-oxidanyl-4-tetradecyl-azetidin-1-yl]hexacosan-1-one
MOLECULAR FORMULA: C50H97NO8
MOLECULAR WEIGHT: 840.30708
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N1[C@@H]([C@H]([C@@H]1CO[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)CCCCCCCCCCCCCC
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Product OPENEYE NAME: 1-[(2S,3R,5R)-3-hydroxy-5-tridecyl-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]pyrrolidin-1-yl]hexacosan-1-one
CAS Name: 1-[(2S,3R,5R)-3-hydroxy-5-tridecyl-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-1-pyrrolidinyl]-1-hexacosanone
IUPAC NAME: 1-[(2S,3R,5R)-3-hydroxy-5-tridecyl-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]pyrrolidin-1-yl]hexacosan-1-one
SYSTEMATIC NAME: 1-[(2S,3R,5R)-2-[[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-3-oxidanyl-5-tridecyl-pyrrolidin-1-yl]hexacosan-1-one
MOLECULAR FORMULA: C50H97NO8
MOLECULAR WEIGHT: 840.30708
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N1[C@@H](C[C@H]([C@@H]1CO[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)CCCCCCCCCCCCC
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Product OPENEYE NAME: (1S,2R)-2-(dodecylamino)-1-phenyl-propan-1-ol
CAS Name: (1S,2R)-2-(dodecylamino)-1-phenyl-1-propanol
IUPAC NAME: (1S,2R)-2-(dodecylamino)-1-phenylpropan-1-ol
SYSTEMATIC NAME: (1S,2R)-2-(dodecylamino)-1-phenyl-propan-1-ol
MOLECULAR FORMULA: C21H37NO
MOLECULAR WEIGHT: 319.52458
SMILES: CCCCCCCCCCCCN[C@H](C)[C@H](C1=CC=CC=C1)O
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Product OPENEYE NAME: 10-ethyl-2-(isobutylamino)-5-oxido-benzo[g]pteridin-5-ium-4-one
CAS Name: 10-ethyl-2-(2-methylpropylamino)-5-oxido-4-benzo[g]pteridin-5-iumone
IUPAC NAME: 10-ethyl-2-(2-methylpropylamino)-5-oxidobenzo[g]pteridin-5-ium-4-one
SYSTEMATIC NAME: 10-ethyl-2-(2-methylpropylamino)-5-oxidanidyl-benzo[g]pteridin-5-ium-4-one
MOLECULAR FORMULA: C16H19N5O2
MOLECULAR WEIGHT: 313.35436
SMILES: CCN1C2=CC=CC=C2[N+](=C3C1=NC(=NC3=O)NCC(C)C)[O-]
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Product OPENEYE NAME: 2-(dimethylamino)-1H-benzo[g]pteridin-4-one
CAS Name: 2-(dimethylamino)-1H-benzo[g]pteridin-4-one
IUPAC NAME: 2-(dimethylamino)-1H-benzo[g]pteridin-4-one
SYSTEMATIC NAME: 2-(dimethylamino)-1H-benzo[g]pteridin-4-one
MOLECULAR FORMULA: C12H11N5O
MOLECULAR WEIGHT: 241.24864
SMILES: CN(C)C1=NC(=O)C2=NC3=CC=CC=C3N=C2N1
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