Product OPENEYE NAME: (3R)-N-methyl-2-[4-(1-piperidylsulfonyl)benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: (3R)-N-methyl-2-[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: (3R)-N-methyl-2-(4-piperidin-1-ylsulfonylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: (3R)-N-methyl-2-(4-piperidin-1-ylsulfonylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C23H27N3O4S
MOLECULAR WEIGHT: 441.54318
SMILES: CNC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4
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Product OPENEYE NAME: (3S)-2-[3-(1,3-dioxoisoindolin-2-yl)propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: (3S)-2-[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: (3S)-2-[3-(1,3-dioxoisoindol-2-yl)propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: (3S)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C22H21N3O4
MOLECULAR WEIGHT: 391.41984
SMILES: CNC(=O)[C@@H]1CC2=CC=CC=C2CN1C(=O)CCN3C(=O)C4=CC=CC=C4C3=O
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Product OPENEYE NAME: (3R)-2-[3-(1,3-dioxoisoindolin-2-yl)propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: (3R)-2-[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: (3R)-2-[3-(1,3-dioxoisoindol-2-yl)propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: (3R)-2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C22H21N3O4
MOLECULAR WEIGHT: 391.41984
SMILES: CNC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)CCN3C(=O)C4=CC=CC=C4C3=O
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Product OPENEYE NAME: (3S)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: (3S)-2-[[1-(3,4-dimethylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: (3S)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: (3S)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C25H31N3O4S
MOLECULAR WEIGHT: 469.59634
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CC4=CC=CC=C4C[C@H]3C(=O)NC)C
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Product OPENEYE NAME: (3R)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name: (3R)-2-[[1-(3,4-dimethylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC NAME: (3R)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
SYSTEMATIC NAME: (3R)-2-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
MOLECULAR FORMULA: C25H31N3O4S
MOLECULAR WEIGHT: 469.59634
SMILES: CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CC4=CC=CC=C4C[C@@H]3C(=O)NC)C
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Product OPENEYE NAME: N-(3-quinolyl)-2-(2-thienyl)acetamide
CAS Name: N-(3-quinolinyl)-2-thiophen-2-ylacetamide
IUPAC NAME: N-quinolin-3-yl-2-thiophen-2-ylacetamide
SYSTEMATIC NAME: N-quinolin-3-yl-2-thiophen-2-yl-ethanamide
MOLECULAR FORMULA: C15H12N2OS
MOLECULAR WEIGHT: 268.33358
SMILES: C1=CC=C2C(=C1)C=C(C=N2)NC(=O)CC3=CC=CS3
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Product OPENEYE NAME: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(3-quinolyl)piperidine-4-carboxamide
CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(3-quinolinyl)-4-piperidinecarboxamide
IUPAC NAME: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-quinolin-3-ylpiperidine-4-carboxamide
SYSTEMATIC NAME: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-quinolin-3-yl-piperidine-4-carboxamide
MOLECULAR FORMULA: C21H18ClF3N4O
MOLECULAR WEIGHT: 434.84203
SMILES: C1CN(CCC1C(=O)NC2=CC3=CC=CC=C3N=C2)C4=C(C=C(C=N4)C(F)(F)F)Cl
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Product OPENEYE NAME: 3-(2,5-dioxopyrrolidin-1-yl)-N-(3-quinolyl)propanamide
CAS Name: 3-(2,5-dioxo-1-pyrrolidinyl)-N-(3-quinolinyl)propanamide
IUPAC NAME: 3-(2,5-dioxopyrrolidin-1-yl)-N-quinolin-3-ylpropanamide
SYSTEMATIC NAME: 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-quinolin-3-yl-propanamide
MOLECULAR FORMULA: C16H15N3O3
MOLECULAR WEIGHT: 297.3086
SMILES: C1CC(=O)N(C1=O)CCC(=O)NC2=CC3=CC=CC=C3N=C2
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Product OPENEYE NAME: [(3S)-2-(3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
CAS Name: [(3S)-2-[(3-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [(3S)-2-(3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [(3S)-2-(3-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C21H21N3O4
MOLECULAR WEIGHT: 379.40914
SMILES: C1CCN(C1)C(=O)[C@@H]2CC3=CC=CC=C3CN2C(=O)C4=CC(=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: [(3R)-2-(3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
CAS Name: [(3R)-2-[(3-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [(3R)-2-(3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [(3R)-2-(3-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C21H21N3O4
MOLECULAR WEIGHT: 379.40914
SMILES: C1CCN(C1)C(=O)[C@H]2CC3=CC=CC=C3CN2C(=O)C4=CC(=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: [(3R)-2-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
CAS Name: [(3R)-2-[[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [(3R)-2-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [(3R)-2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C26H28N4O2
MOLECULAR WEIGHT: 428.52612
SMILES: CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CC4=CC=CC=C4C[C@@H]3C(=O)N5CCCC5)C
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Product OPENEYE NAME: [(3S)-2-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
CAS Name: [(3S)-2-[[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone
IUPAC NAME: [(3S)-2-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone
SYSTEMATIC NAME: [(3S)-2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone
MOLECULAR FORMULA: C26H28N4O2
MOLECULAR WEIGHT: 428.52612
SMILES: CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CC4=CC=CC=C4C[C@H]3C(=O)N5CCCC5)C
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Product OPENEYE NAME: ethyl (3R)-4-(3-chlorobenzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-(3-chloro-1-benzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C16H16ClNO3S2
MOLECULAR WEIGHT: 369.88614
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=C(C3=CC=CC=C3S2)Cl
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Product OPENEYE NAME: ethyl (3S)-4-(3-chlorobenzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-(3-chloro-1-benzothiophene-2-carbonyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]thiomorpholine-3-carboxylate
MOLECULAR FORMULA: C16H16ClNO3S2
MOLECULAR WEIGHT: 369.88614
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=C(C3=CC=CC=C3S2)Cl
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Product OPENEYE NAME: ethyl (3R)-4-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[4-(3,5-dimethylpyrazol-1-yl)phenyl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H23N3O3S
MOLECULAR WEIGHT: 373.46922
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C)C
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Product OPENEYE NAME: ethyl (3S)-4-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]thiomorpholine-3-carboxylate
CAS Name: (3S)-4-[[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3S)-4-[4-(3,5-dimethylpyrazol-1-yl)benzoyl]thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3S)-4-[4-(3,5-dimethylpyrazol-1-yl)phenyl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C19H23N3O3S
MOLECULAR WEIGHT: 373.46922
SMILES: CCOC(=O)[C@H]1CSCCN1C(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C)C
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Product OPENEYE NAME: ethyl (3R)-4-(4,5-dibromothiophene-2-carbonyl)thiomorpholine-3-carboxylate
CAS Name: (3R)-4-[(4,5-dibromo-2-thiophenyl)-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (3R)-4-(4,5-dibromothiophene-2-carbonyl)thiomorpholine-3-carboxylate
SYSTEMATIC NAME: ethyl (3R)-4-[4,5-bis(bromanyl)thiophen-2-yl]carbonylthiomorpholine-3-carboxylate
MOLECULAR FORMULA: C12H13Br2NO3S2
MOLECULAR WEIGHT: 443.17452
SMILES: CCOC(=O)[C@@H]1CSCCN1C(=O)C2=CC(=C(S2)Br)Br
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