Product OPENEYE NAME: 3-(4-phenylphenyl)-5-(2,4,6-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole
CAS Name: 3-(4-phenylphenyl)-5-(2,4,6-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole
IUPAC NAME: 3-(4-phenylphenyl)-5-(2,4,6-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole
SYSTEMATIC NAME: 3-(4-phenylphenyl)-5-(2,4,6-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole
MOLECULAR FORMULA: C24H24N2O3
MOLECULAR WEIGHT: 388.45896
SMILES: COC1=CC(=C(C(=C1)OC)C2CC(=NN2)C3=CC=C(C=C3)C4=CC=CC=C4)OC
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Product OPENEYE NAME: [(2R,3R,4S,5S)-3-acetoxy-5-(dimethoxyphosphorylamino)-2-phosphonooxy-tetrahydropyran-4-yl] acetate
CAS Name: acetic acid [(2R,3R,4S,5S)-3-acetyloxy-5-(dimethoxyphosphorylamino)-2-phosphonooxy-4-oxanyl] ester
IUPAC NAME: [(2R,3R,4S,5S)-3-acetyloxy-5-(dimethoxyphosphorylamino)-2-phosphonooxyoxan-4-yl] acetate
SYSTEMATIC NAME: [(2R,3R,4S,5S)-3-acetyloxy-5-(dimethoxyphosphorylamino)-2-phosphonooxy-oxan-4-yl] ethanoate
MOLECULAR FORMULA: C11H21NO12P2
MOLECULAR WEIGHT: 421.231462
SMILES: CC(=O)O[C@H]1[C@H](CO[C@@H]([C@@H]1OC(=O)C)OP(=O)(O)O)NP(=O)(OC)OC
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Product OPENEYE NAME: [[(2R,3R,4S,5S)-3,4-diacetoxy-5-(dimethoxyphosphorylamino)tetrahydropyran-2-yl]oxy-hydroxy-phosphoryl]oxy-[[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]phosphinic acid
CAS Name: [[(2R,3R,4S,5S)-3,4-diacetyloxy-5-(dimethoxyphosphorylamino)-2-oxanyl]oxy-hydroxyphosphoryl]oxy-[[(2S,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl]phosphinic acid
IUPAC NAME: [[(2R,3R,4S,5S)-3,4-diacetyloxy-5-(dimethoxyphosphorylamino)oxan-2-yl]oxy-hydroxyphosphoryl]oxy-[[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl]phosphinic acid
SYSTEMATIC NAME: [(2S,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[[(2R,3R,4S,5S)-3,4-diacetyloxy-5-(dimethoxyphosphorylamino)oxan-2-yl]oxy-oxidanyl-phosphoryl]oxy-phosphinic acid
MOLECULAR FORMULA: C20H32N3O19P3
MOLECULAR WEIGHT: 711.398063
SMILES: CC(=O)O[C@H]1[C@H](CO[C@@H]([C@@H]1OC(=O)C)OP(=O)(O)OP(=O)(C[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=O)NC3=O)O)O)O)NP(=O)(OC)OC
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Product OPENEYE NAME: 5-(4-methoxyphenyl)-3-(4-phenylphenyl)-4,5-dihydro-1H-pyrazole
CAS Name: 5-(4-methoxyphenyl)-3-(4-phenylphenyl)-4,5-dihydro-1H-pyrazole
IUPAC NAME: 5-(4-methoxyphenyl)-3-(4-phenylphenyl)-4,5-dihydro-1H-pyrazole
SYSTEMATIC NAME: 5-(4-methoxyphenyl)-3-(4-phenylphenyl)-4,5-dihydro-1H-pyrazole
MOLECULAR FORMULA: C22H20N2O
MOLECULAR WEIGHT: 328.407
SMILES: COC1=CC=C(C=C1)C2CC(=NN2)C3=CC=C(C=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (2-prop-2-ynyl-3,4-dihydro-1H-isoquinolin-7-yl) N-ethyl-N-methyl-carbamate
CAS Name: N-ethyl-N-methylcarbamic acid (2-prop-2-ynyl-3,4-dihydro-1H-isoquinolin-7-yl) ester
IUPAC NAME: (2-prop-2-ynyl-3,4-dihydro-1H-isoquinolin-7-yl) N-ethyl-N-methylcarbamate
SYSTEMATIC NAME: (2-prop-2-ynyl-3,4-dihydro-1H-isoquinolin-7-yl) N-ethyl-N-methyl-carbamate
MOLECULAR FORMULA: C16H20N2O2
MOLECULAR WEIGHT: 272.3422
SMILES: CCN(C)C(=O)OC1=CC2=C(CCN(C2)CC#C)C=C1
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MOLECULAR FORMULA: C41H51N7O9
MOLECULAR WEIGHT: 785.88514
SMILES: C[C@@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H]2CC3=CC=C(C=C3)OC4=CC(=CC(=C4OC)N)C[C@@H](C(=O)N1)N(C2=O)C)C)C)CC5=CC=C(C=C5)OC)C)C
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MOLECULAR FORMULA: C41H50N6O10
MOLECULAR WEIGHT: 786.8699
SMILES: C[C@@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H]2CC3=CC=C(C=C3)OC4=C(C=C(C(=C4)C[C@@H](C(=O)N1)N(C2=O)C)O)OC)C)C)CC5=CC=C(C=C5)OC)C)C
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Product OPENEYE NAME: 1-[2-[[4-[3-methyl-4-(2-pyridylmethoxy)anilino]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy]ethyl]piperidin-4-ol
CAS Name: 1-[2-[[4-[3-methyl-4-(2-pyridinylmethoxy)anilino]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy]ethyl]-4-piperidinol
IUPAC NAME: 1-[2-[[4-[3-methyl-4-(pyridin-2-ylmethoxy)anilino]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy]ethyl]piperidin-4-ol
SYSTEMATIC NAME: 1-[2-[[4-[[3-methyl-4-(pyridin-2-ylmethoxy)phenyl]amino]-1H-pyrazolo[3,4-d]pyrimidin-3-yl]oxy]ethyl]piperidin-4-ol
MOLECULAR FORMULA: C25H29N7O3
MOLECULAR WEIGHT: 475.54286
SMILES: CC1=C(C=CC(=C1)NC2=NC=NC3=C2C(=NN3)OCCN4CCC(CC4)O)OCC5=CC=CC=N5
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Product OPENEYE NAME: 4-(4-chlorophenoxy)-N-(1-hydroxy-4-methyl-2-oxo-3-pyridyl)-N-methyl-benzenesulfonamide
CAS Name: 4-(4-chlorophenoxy)-N-(1-hydroxy-4-methyl-2-oxo-3-pyridinyl)-N-methylbenzenesulfonamide
IUPAC NAME: 4-(4-chlorophenoxy)-N-(1-hydroxy-4-methyl-2-oxopyridin-3-yl)-N-methylbenzenesulfonamide
SYSTEMATIC NAME: 4-(4-chloranylphenoxy)-N-methyl-N-(4-methyl-1-oxidanyl-2-oxidanylidene-pyridin-3-yl)benzenesulfonamide
MOLECULAR FORMULA: C19H17ClN2O5S
MOLECULAR WEIGHT: 420.86668
SMILES: CC1=C(C(=O)N(C=C1)O)N(C)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-(5-bromo-1-hydroxy-2-oxo-3-pyridyl)-4-(4-chlorophenoxy)-N-methyl-benzenesulfonamide
CAS Name: N-(5-bromo-1-hydroxy-2-oxo-3-pyridinyl)-4-(4-chlorophenoxy)-N-methylbenzenesulfonamide
IUPAC NAME: N-(5-bromo-1-hydroxy-2-oxopyridin-3-yl)-4-(4-chlorophenoxy)-N-methylbenzenesulfonamide
SYSTEMATIC NAME: N-(5-bromanyl-1-oxidanyl-2-oxidanylidene-pyridin-3-yl)-4-(4-chloranylphenoxy)-N-methyl-benzenesulfonamide
MOLECULAR FORMULA: C18H14BrClN2O5S
MOLECULAR WEIGHT: 485.73616
SMILES: CN(C1=CC(=CN(C1=O)O)Br)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-[4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl]benzenesulfonamide
CAS Name: N-[4-[4-amino-6-(4-methoxyphenyl)-5-furo[2,3-d]pyrimidinyl]phenyl]benzenesulfonamide
IUPAC NAME: N-[4-[4-amino-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl]benzenesulfonamide
SYSTEMATIC NAME: N-[4-[4-azanyl-6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-5-yl]phenyl]benzenesulfonamide
MOLECULAR FORMULA: C25H20N4O4S
MOLECULAR WEIGHT: 472.5157
SMILES: COC1=CC=C(C=C1)C2=C(C3=C(N=CN=C3O2)N)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5
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Product OPENEYE NAME: N1-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4S)-4-(2-phenylethyl)-2-piperidyl]ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-(2-phenylethyl)-2-piperidinyl]propan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4S)-4-(2-phenylethyl)piperidin-2-yl]propan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-oxidanyl-1-[(2R,4S)-4-(2-phenylethyl)piperidin-2-yl]propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C37H47F2N3O3
MOLECULAR WEIGHT: 619.784186
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)CCC4=CC=CC=C4)O)C
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Product OPENEYE NAME: N1-[(1S,2R)-2-[(2R,4S)-4-cyclohexyl-2-piperidyl]-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-ethyl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
CAS Name: N1-[(1R,2S)-1-[(2R,4S)-4-cyclohexyl-2-piperidinyl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]-5-methyl-N3,N3-dipropylbenzene-1,3-dicarboxamide
IUPAC NAME: 1-N-[(1R,2S)-1-[(2R,4S)-4-cyclohexylpiperidin-2-yl]-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl]-5-methyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
SYSTEMATIC NAME: N1-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-[(2R,4S)-4-cyclohexylpiperidin-2-yl]-1-oxidanyl-propan-2-yl]-5-methyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide
MOLECULAR FORMULA: C35H49F2N3O3
MOLECULAR WEIGHT: 597.778666
SMILES: CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)N[C@@H](CC2=CC(=CC(=C2)F)F)[C@@H]([C@H]3C[C@H](CCN3)C4CCCCC4)O)C
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Product OPENEYE NAME: (2S)-2-[[(3R,4R)-4-[6-fluoro-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-benzimidazol-1-yl]-3-methoxy-1-piperidyl]methyl]indane-5-carbonitrile
CAS Name: (2S)-2-[[(3R,4R)-4-[6-fluoro-2-(2-hydroxypropan-2-yl)-5-methyl-1-benzimidazolyl]-3-methoxy-1-piperidinyl]methyl]-2,3-dihydro-1H-indene-5-carbonitrile
IUPAC NAME: (2S)-2-[[(3R,4R)-4-[6-fluoro-2-(2-hydroxypropan-2-yl)-5-methylbenzimidazol-1-yl]-3-methoxypiperidin-1-yl]methyl]-2,3-dihydro-1H-indene-5-carbonitrile
SYSTEMATIC NAME: (2S)-2-[[(3R,4R)-4-[6-fluoranyl-5-methyl-2-(2-oxidanylpropan-2-yl)benzimidazol-1-yl]-3-methoxy-piperidin-1-yl]methyl]-2,3-dihydro-1H-indene-5-carbonitrile
MOLECULAR FORMULA: C28H33FN4O2
MOLECULAR WEIGHT: 476.585623
SMILES: CC1=CC2=C(C=C1F)N(C(=N2)C(C)(C)O)[C@@H]3CCN(C[C@H]3OC)C[C@H]4CC5=C(C4)C=C(C=C5)C#N
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Product OPENEYE NAME: 3,6-bis(o-tolyl)-1,2,4,5-tetraoxane
CAS Name: 3,6-bis(2-methylphenyl)-1,2,4,5-tetraoxane
IUPAC NAME: 3,6-bis(2-methylphenyl)-1,2,4,5-tetraoxane
SYSTEMATIC NAME: 3,6-bis(2-methylphenyl)-1,2,4,5-tetraoxane
MOLECULAR FORMULA: C16H16O4
MOLECULAR WEIGHT: 272.29584
SMILES: CC1=CC=CC=C1C2OOC(OO2)C3=CC=CC=C3C
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Product OPENEYE NAME: 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-(2-hydroxyethoxy)cyclohexyl]phenol
CAS Name: 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-(2-hydroxyethoxy)cyclohexyl]phenol
IUPAC NAME: 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-(2-hydroxyethoxy)cyclohexyl]phenol
SYSTEMATIC NAME: 3-[(1R,2R)-2-[(dimethylamino)methyl]-1-(2-hydroxyethyloxy)cyclohexyl]phenol
MOLECULAR FORMULA: C17H27NO3
MOLECULAR WEIGHT: 293.40118
SMILES: CN(C)C[C@H]1CCCC[C@@]1(C2=CC(=CC=C2)O)OCCO
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Product OPENEYE NAME: 4-(4-benzyloxyphenyl)-3,5-dimethyl-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-phenylmethoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-phenylmethoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-phenylmethoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C18H18N2O2
MOLECULAR WEIGHT: 294.34772
SMILES: CC1=C(N(C(=O)N1)C)C2=CC=C(C=C2)OCC3=CC=CC=C3
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Product OPENEYE NAME: 2-[[4-(7,7-diphosphonoheptoxycarbonyloxy)-3,5-dimethoxy-phenyl]methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid
CAS Name: 2-[[[4-[7,7-diphosphonoheptoxy(oxo)methoxy]-3,5-dimethoxyphenyl]methoxy-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid
IUPAC NAME: 2-[[4-(7,7-diphosphonoheptoxycarbonyloxy)-3,5-dimethoxyphenyl]methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: 2-[[4-(7,7-diphosphonoheptoxycarbonyloxy)-3,5-dimethoxy-phenyl]methoxycarbonylamino]-3-(1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C29H38N2O15P2
MOLECULAR WEIGHT: 716.563942
SMILES: COC1=CC(=CC(=C1OC(=O)OCCCCCCC(P(=O)(O)O)P(=O)(O)O)OC)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-phenoxyphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-phenoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-phenoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-phenoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C17H16N2O2
MOLECULAR WEIGHT: 280.32114
SMILES: CC1=C(N(C(=O)N1)C)C2=CC=C(C=C2)OC3=CC=CC=C3
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-octadecoxyphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-octadecoxyphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-octadecoxyphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-octadecoxyphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C29H48N2O2
MOLECULAR WEIGHT: 456.70362
SMILES: CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(NC(=O)N2C)C
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Product OPENEYE NAME: 3,5-dimethyl-4-(4-phenylphenyl)-1H-imidazol-2-one
CAS Name: 3,5-dimethyl-4-(4-phenylphenyl)-1H-imidazol-2-one
IUPAC NAME: 3,5-dimethyl-4-(4-phenylphenyl)-1H-imidazol-2-one
SYSTEMATIC NAME: 3,5-dimethyl-4-(4-phenylphenyl)-1H-imidazol-2-one
MOLECULAR FORMULA: C17H16N2O
MOLECULAR WEIGHT: 264.32174
SMILES: CC1=C(N(C(=O)N1)C)C2=CC=C(C=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 1-[3-[(1R,5S)-3-(2-methylbenzimidazol-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-1-phenyl-3-(p-tolyl)urea
CAS Name: 1-[3-[(1R,5S)-3-(2-methyl-1-benzimidazolyl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
IUPAC NAME: 1-[3-[(1R,5S)-3-(2-methylbenzimidazol-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenylurea
SYSTEMATIC NAME: 1-[3-[(1R,5S)-3-(2-methylbenzimidazol-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-3-(4-methylphenyl)-1-phenyl-urea
MOLECULAR FORMULA: C32H37N5O
MOLECULAR WEIGHT: 507.66908
SMILES: CC1=CC=C(C=C1)NC(=O)N(CCCN2[C@@H]3CC[C@H]2CC(C3)N4C(=NC5=CC=CC=C54)C)C6=CC=CC=C6
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Product OPENEYE NAME: N-cyano-4-[2-(1H-imidazol-5-yl)acetyl]-N'-(o-tolyl)-3-phenyl-piperazine-1-carboxamidine
CAS Name: N-cyano-4-[2-(1H-imidazol-5-yl)-1-oxoethyl]-N'-(2-methylphenyl)-3-phenyl-1-piperazinecarboximidamide
IUPAC NAME: N-cyano-4-[2-(1H-imidazol-5-yl)acetyl]-N'-(2-methylphenyl)-3-phenylpiperazine-1-carboximidamide
SYSTEMATIC NAME: N-cyano-4-[2-(1H-imidazol-5-yl)ethanoyl]-N'-(2-methylphenyl)-3-phenyl-piperazine-1-carboximidamide
MOLECULAR FORMULA: C24H25N7O
MOLECULAR WEIGHT: 427.5016
SMILES: CC1=CC=CC=C1N=C(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)CC4=CN=CN4
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Product OPENEYE NAME: dimethyl 1-[(6aS,8S)-3-benzyloxy-2-methoxy-11-oxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]triazole-4,5-dicarboxylate
CAS Name: 1-[(6aS,8S)-2-methoxy-11-oxo-3-phenylmethoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]triazole-4,5-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 1-[(6aS,8S)-2-methoxy-11-oxo-3-phenylmethoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]triazole-4,5-dicarboxylate
SYSTEMATIC NAME: dimethyl 1-[(6aS,8S)-2-methoxy-11-oxidanylidene-3-phenylmethoxy-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1,2,3-triazole-4,5-dicarboxylate
MOLECULAR FORMULA: C26H25N5O7
MOLECULAR WEIGHT: 519.506
SMILES: COC1=C(C=C2C(=C1)C(=O)N3C[C@H](C[C@H]3C=N2)N4C(=C(N=N4)C(=O)OC)C(=O)OC)OCC5=CC=CC=C5
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