3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-[(8-oxidanyl-1,3,4,5-tetrahydro-2-benzazepin-2-yl)carbonyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-[(8-oxidanyl-1,3,4,5-tetrahydro-2-benzazepin-2-yl)carbonyl]-1H-pyrrole-2-carboxamide Openeye Name: 3-(3,5-dimethylphenyl)sulfonyl-5-(8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-4-methyl-1H-pyrrole-2-carboxamide CAS Name: 3-(3,5-dimethylphenyl)sulfonyl-5-[(8-hydroxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-oxomethyl]-4-methyl-1H-pyrrole-2-carboxamide IUPAC Name: 3-(3,5-dimethylphenyl)sulfonyl-5-(8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-4-methyl-1H-pyrrole-2-carboxamide Traditional Name: 3-(3,5-dimethylphenyl)sulfonyl-5-(8-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-4-methyl-1H-pyrrole-2-carboxamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N3CCCC4=C(C3)C=C(C=C4)O)C(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N3CCCC4=C(C3)C=C(C=C4)O)C(=O)N)C

InChI

InChI=1S/C25H27N3O5S/c1-14-9-15(2)11-20(10-14)34(32,33)23-16(3)21(27-22(23)24(26)30)25(31)28-8-4-5-17-6-7-19(29)12-18(17)13-28/h6-7,9-12,27,29H,4-5,8,13H2,1-3H3,(H2,26,30)