Product OPENEYE NAME: 3-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]benzonitrile
CAS Name: 3-[[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]benzonitrile
IUPAC NAME: 3-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]benzonitrile
SYSTEMATIC NAME: 3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylbenzenecarbonitrile
MOLECULAR FORMULA: C19H21N3O
MOLECULAR WEIGHT: 307.38954
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)C3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 3-[(2R)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]benzonitrile
CAS Name: 3-[[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]benzonitrile
IUPAC NAME: 3-[(2R)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]benzonitrile
SYSTEMATIC NAME: 3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonylbenzenecarbonitrile
MOLECULAR FORMULA: C19H21N3O
MOLECULAR WEIGHT: 307.38954
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)C3=CC=CC(=C3)C#N
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Product OPENEYE NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone
IUPAC NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
SYSTEMATIC NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
MOLECULAR FORMULA: C20H23N3OS2
MOLECULAR WEIGHT: 385.54612
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)CSC3=NC4=CC=CC=C4S3
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Product OPENEYE NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone
IUPAC NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
SYSTEMATIC NAME: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone
MOLECULAR FORMULA: C20H23N3OS2
MOLECULAR WEIGHT: 385.54612
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)CSC3=NC4=CC=CC=C4S3
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Product OPENEYE NAME: [(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
CAS Name: [(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-(3-methylsulfonylphenyl)methanone
IUPAC NAME: [(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
SYSTEMATIC NAME: [(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
MOLECULAR FORMULA: C19H24N2O3S
MOLECULAR WEIGHT: 360.47046
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)C3=CC(=CC=C3)S(=O)(=O)C
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Product OPENEYE NAME: [(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
CAS Name: [(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-(3-methylsulfonylphenyl)methanone
IUPAC NAME: [(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
SYSTEMATIC NAME: [(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-(3-methylsulfonylphenyl)methanone
MOLECULAR FORMULA: C19H24N2O3S
MOLECULAR WEIGHT: 360.47046
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)C3=CC(=CC=C3)S(=O)(=O)C
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Product OPENEYE NAME: 1-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxo-ethyl]-3-propyl-benzimidazol-2-one
CAS Name: 1-[2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-2-oxoethyl]-3-propyl-2-benzimidazolone
IUPAC NAME: 1-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxoethyl]-3-propylbenzimidazol-2-one
SYSTEMATIC NAME: 1-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one
MOLECULAR FORMULA: C23H30N4O2
MOLECULAR WEIGHT: 394.5099
SMILES: CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCC[C@@H]3C4=CC=CN4C
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Product OPENEYE NAME: 1-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxo-ethyl]-3-propyl-benzimidazol-2-one
CAS Name: 1-[2-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-2-oxoethyl]-3-propyl-2-benzimidazolone
IUPAC NAME: 1-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxoethyl]-3-propylbenzimidazol-2-one
SYSTEMATIC NAME: 1-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one
MOLECULAR FORMULA: C23H30N4O2
MOLECULAR WEIGHT: 394.5099
SMILES: CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCC[C@H]3C4=CC=CN4C
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Product OPENEYE NAME: 8-methyl-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxo-propyl]quinazolin-4-one
CAS Name: 8-methyl-3-[3-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-3-oxopropyl]-4-quinazolinone
IUPAC NAME: 8-methyl-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxopropyl]quinazolin-4-one
SYSTEMATIC NAME: 8-methyl-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one
MOLECULAR FORMULA: C23H28N4O2
MOLECULAR WEIGHT: 392.49402
SMILES: CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)N3CCCCC[C@@H]3C4=CC=CN4C
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Product OPENEYE NAME: 8-methyl-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxo-propyl]quinazolin-4-one
CAS Name: 8-methyl-3-[3-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-3-oxopropyl]-4-quinazolinone
IUPAC NAME: 8-methyl-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxopropyl]quinazolin-4-one
SYSTEMATIC NAME: 8-methyl-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one
MOLECULAR FORMULA: C23H28N4O2
MOLECULAR WEIGHT: 392.49402
SMILES: CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)N3CCCCC[C@H]3C4=CC=CN4C
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Product OPENEYE NAME: 10-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxo-ethyl]acridin-9-one
CAS Name: 10-[2-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-2-oxoethyl]-9-acridinone
IUPAC NAME: 10-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxoethyl]acridin-9-one
SYSTEMATIC NAME: 10-[2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]acridin-9-one
MOLECULAR FORMULA: C26H27N3O2
MOLECULAR WEIGHT: 413.51148
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)CN3C4=CC=CC=C4C(=O)C5=CC=CC=C53
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Product OPENEYE NAME: 10-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxo-ethyl]acridin-9-one
CAS Name: 10-[2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-2-oxoethyl]-9-acridinone
IUPAC NAME: 10-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxoethyl]acridin-9-one
SYSTEMATIC NAME: 10-[2-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]acridin-9-one
MOLECULAR FORMULA: C26H27N3O2
MOLECULAR WEIGHT: 413.51148
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)CN3C4=CC=CC=C4C(=O)C5=CC=CC=C53
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Product OPENEYE NAME: 6-bromo-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxo-propyl]quinazolin-4-one
CAS Name: 6-bromo-3-[3-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-3-oxopropyl]-4-quinazolinone
IUPAC NAME: 6-bromo-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxopropyl]quinazolin-4-one
SYSTEMATIC NAME: 6-bromanyl-3-[3-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one
MOLECULAR FORMULA: C22H25BrN4O2
MOLECULAR WEIGHT: 457.3635
SMILES: CN1C=CC=C1[C@@H]2CCCCCN2C(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br
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Product OPENEYE NAME: 6-bromo-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxo-propyl]quinazolin-4-one
CAS Name: 6-bromo-3-[3-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-3-oxopropyl]-4-quinazolinone
IUPAC NAME: 6-bromo-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxopropyl]quinazolin-4-one
SYSTEMATIC NAME: 6-bromanyl-3-[3-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one
MOLECULAR FORMULA: C22H25BrN4O2
MOLECULAR WEIGHT: 457.3635
SMILES: CN1C=CC=C1[C@H]2CCCCCN2C(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br
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Product OPENEYE NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C20H25N5O
MOLECULAR WEIGHT: 351.4454
SMILES: CC1=NN(C2=NC=C(C=C12)C(=O)N3CCCCC[C@@H]3C4=CC=CN4C)C
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Product OPENEYE NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
CAS Name: (1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone
IUPAC NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
SYSTEMATIC NAME: (1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone
MOLECULAR FORMULA: C20H25N5O
MOLECULAR WEIGHT: 351.4454
SMILES: CC1=NN(C2=NC=C(C=C12)C(=O)N3CCCCC[C@H]3C4=CC=CN4C)C
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Product OPENEYE NAME: N-[4-[(E)-3-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxo-prop-1-enyl]thiazol-2-yl]-N-phenyl-acetamide
CAS Name: N-[4-[(E)-3-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxoprop-1-enyl]-2-thiazolyl]-N-phenylacetamide
IUPAC NAME: N-[4-[(E)-3-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxoprop-1-enyl]-1,3-thiazol-2-yl]-N-phenylacetamide
SYSTEMATIC NAME: N-[4-[(E)-3-[(4R)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxidanylidene-prop-1-enyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C25H25N3O5S
MOLECULAR WEIGHT: 479.5481
SMILES: CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)/C=C/C(=O)N3C[C@@H](C4=C(C=CC(=C4C3)OC)OC)O
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Product OPENEYE NAME: N-[4-[(E)-3-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxo-prop-1-enyl]thiazol-2-yl]-N-phenyl-acetamide
CAS Name: N-[4-[(E)-3-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxoprop-1-enyl]-2-thiazolyl]-N-phenylacetamide
IUPAC NAME: N-[4-[(E)-3-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxoprop-1-enyl]-1,3-thiazol-2-yl]-N-phenylacetamide
SYSTEMATIC NAME: N-[4-[(E)-3-[(4S)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-oxidanylidene-prop-1-enyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C25H25N3O5S
MOLECULAR WEIGHT: 479.5481
SMILES: CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)/C=C/C(=O)N3C[C@H](C4=C(C=CC(=C4C3)OC)OC)O
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Product OPENEYE NAME: (E)-1-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
CAS Name: (E)-1-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propen-1-one
IUPAC NAME: (E)-1-[(4R)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[(4R)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
MOLECULAR FORMULA: C23H25NO7
MOLECULAR WEIGHT: 427.4471
SMILES: COC1=C2CN(C[C@@H](C2=C(C=C1)OC)O)C(=O)/C=C/C3=CC4=C(C(=C3)OC)OCCO4
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Product OPENEYE NAME: (E)-1-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
CAS Name: (E)-1-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propen-1-one
IUPAC NAME: (E)-1-[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-1-[(4S)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one
MOLECULAR FORMULA: C23H25NO7
MOLECULAR WEIGHT: 427.4471
SMILES: COC1=C2CN(C[C@H](C2=C(C=C1)OC)O)C(=O)/C=C/C3=CC4=C(C(=C3)OC)OCCO4
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