Product OPENEYE NAME: 2-[4-(2,4-dichloro-5-fluoro-benzoyl)piperazin-1-yl]-1-[(2S)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(2,4-dichloro-5-fluorophenyl)-oxomethyl]-1-piperazinyl]-1-[(2S)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(2,4-dichloro-5-fluorobenzoyl)piperazin-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]carbonylpiperazin-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C19H24Cl2FN3O2
MOLECULAR WEIGHT: 416.317163
SMILES: C[C@H]1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3Cl)Cl)F
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Product OPENEYE NAME: N-(3-chlorophenyl)-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]methanesulfonamide
CAS Name: N-(3-chlorophenyl)-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]methanesulfonamide
IUPAC NAME: N-(3-chlorophenyl)-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]methanesulfonamide
SYSTEMATIC NAME: N-(3-chlorophenyl)-N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]methanesulfonamide
MOLECULAR FORMULA: C20H23ClN2O5S
MOLECULAR WEIGHT: 438.92502
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)CN(C3=CC(=CC=C3)Cl)S(=O)(=O)C)OC
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Product OPENEYE NAME: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[(3R)-1,1-dioxothiolan-3-yl]benzenesulfonamide
CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-N-[(3R)-1,1-dioxo-3-thiolanyl]benzenesulfonamide
IUPAC NAME: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[(3R)-1,1-dioxothiolan-3-yl]benzenesulfonamide
SYSTEMATIC NAME: N-[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide
MOLECULAR FORMULA: C22H26N2O7S2
MOLECULAR WEIGHT: 494.58104
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N[C@@H]4CCS(=O)(=O)C4)OC
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Product OPENEYE NAME: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[(3S)-1,1-dioxothiolan-3-yl]benzenesulfonamide
CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]benzenesulfonamide
IUPAC NAME: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[(3S)-1,1-dioxothiolan-3-yl]benzenesulfonamide
SYSTEMATIC NAME: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide
MOLECULAR FORMULA: C22H26N2O7S2
MOLECULAR WEIGHT: 494.58104
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N[C@H]4CCS(=O)(=O)C4)OC
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Product OPENEYE NAME: N-[[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]acetamide
CAS Name: N-[[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]methyl]acetamide
IUPAC NAME: N-[[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]acetamide
SYSTEMATIC NAME: N-[[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]methyl]ethanamide
MOLECULAR FORMULA: C21H24N2O4
MOLECULAR WEIGHT: 368.42626
SMILES: CC(=O)NCC1=CC=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC
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Product OPENEYE NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]methanone
CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]methanone
IUPAC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]methanone
SYSTEMATIC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]methanone
MOLECULAR FORMULA: C23H26N2O4
MOLECULAR WEIGHT: 394.46354
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
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Product OPENEYE NAME: N-[2-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide
CAS Name: N-[2-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]-2-oxoethyl]-2-thiophenecarboxamide
IUPAC NAME: N-[2-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide
SYSTEMATIC NAME: N-[2-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide
MOLECULAR FORMULA: C20H23N3O5S
MOLECULAR WEIGHT: 417.47872
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)CNC(=O)CNC(=O)C3=CC=CS3)OC
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Product OPENEYE NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(6-fluorobenzothiophen-2-yl)methanone
CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(6-fluoro-1-benzothiophen-2-yl)methanone
IUPAC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(6-fluoro-1-benzothiophen-2-yl)methanone
SYSTEMATIC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(6-fluoranyl-1-benzothiophen-2-yl)methanone
MOLECULAR FORMULA: C20H18FNO3S
MOLECULAR WEIGHT: 371.425223
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC4=C(S3)C=C(C=C4)F)OC
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Product OPENEYE NAME: 2-(1,3-benzothiazol-2-ylmethoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
IUPAC NAME: 2-(1,3-benzothiazol-2-ylmethoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
SYSTEMATIC NAME: 2-(1,3-benzothiazol-2-ylmethoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
MOLECULAR FORMULA: C21H22N2O4S
MOLECULAR WEIGHT: 398.47538
SMILES: COC1=C(C=C2CN(CCC2=C1)C(=O)COCC3=NC4=CC=CC=C4S3)OC
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Product OPENEYE NAME: tert-butyl 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidine-1-carboxylate
CAS Name: 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidine-1-carboxylate
SYSTEMATIC NAME: tert-butyl 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C22H32N2O5
MOLECULAR WEIGHT: 404.49988
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC
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Product OPENEYE NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methoxy-5-nitro-phenyl)methanone
CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methoxy-5-nitrophenyl)methanone
IUPAC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methoxy-5-nitrophenyl)methanone
SYSTEMATIC NAME: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methoxy-5-nitro-phenyl)methanone
MOLECULAR FORMULA: C19H20N2O6
MOLECULAR WEIGHT: 372.3719
SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC
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Product OPENEYE NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide
CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide
IUPAC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide
SYSTEMATIC NAME: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanamide
MOLECULAR FORMULA: C19H23N5O2S
MOLECULAR WEIGHT: 385.48322
SMILES: CC1=C(C(=O)N=C(N1)C)CC(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2
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Product OPENEYE NAME: 2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(3-methoxy-4-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-[(2S)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C21H32N3O3+
MOLECULAR WEIGHT: 374.49708
SMILES: C[C@H]1CCCCN1C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC
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Product OPENEYE NAME: 2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-yl]-1-[(2S)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(3-methoxy-4-methylphenyl)-oxomethyl]-1-piperazinyl]-1-[(2S)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C21H31N3O3
MOLECULAR WEIGHT: 373.48914
SMILES: C[C@H]1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC
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Product OPENEYE NAME: 2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(3-methoxy-4-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-[(2R)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-ium-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C21H32N3O3+
MOLECULAR WEIGHT: 374.49708
SMILES: C[C@@H]1CCCCN1C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC
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Product OPENEYE NAME: 2-[4-(3-methoxy-4-methyl-benzoyl)piperazin-1-yl]-1-[(2R)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(3-methoxy-4-methylphenyl)-oxomethyl]-1-piperazinyl]-1-[(2R)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(3-methoxy-4-methyl-phenyl)carbonylpiperazin-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C21H31N3O3
MOLECULAR WEIGHT: 373.48914
SMILES: C[C@@H]1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)OC
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Product OPENEYE NAME: ethyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]amino]-3-oxo-propyl]carbamate
CAS Name: N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]amino]-3-oxopropyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]amino]-3-oxopropyl]carbamate
SYSTEMATIC NAME: ethyl N-[3-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]amino]-3-oxidanylidene-propyl]carbamate
MOLECULAR FORMULA: C17H24N4O3S
MOLECULAR WEIGHT: 364.46246
SMILES: CCOC(=O)NCCC(=O)N[C@@H](CCSC)C1=NC2=CC=CC=C2N1
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Product OPENEYE NAME: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanone
CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)ethanone
IUPAC NAME: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)ethanone
SYSTEMATIC NAME: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanone
MOLECULAR FORMULA: C24H27N3O3
MOLECULAR WEIGHT: 405.48948
SMILES: CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
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Product OPENEYE NAME: 2-[4-(4-bromo-2-fluoro-benzoyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methyl-1-piperidyl]ethanone
CAS Name: 2-[4-[(4-bromo-2-fluorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-[(2R)-2-methyl-1-piperidinyl]ethanone
IUPAC NAME: 2-[4-(4-bromo-2-fluorobenzoyl)piperazin-1-ium-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-[4-(4-bromanyl-2-fluoranyl-phenyl)carbonylpiperazin-1-ium-1-yl]-1-[(2R)-2-methylpiperidin-1-yl]ethanone
MOLECULAR FORMULA: C19H26BrFN3O2+
MOLECULAR WEIGHT: 427.331043
SMILES: C[C@@H]1CCCCN1C(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C=C(C=C3)Br)F
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