3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylcarbonyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylcarbonyl)-1H-pyrrole-2-carboxamide Openeye Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-(1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-1H-pyrrole-2-carboxamide CAS Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-[oxo(1,3,4,5-tetrahydro-2-benzazepin-2-yl)methyl]-1H-pyrrole-2-carboxamide IUPAC Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-(1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-1H-pyrrole-2-carboxamide Traditional Name: 3-(3,5-dimethylphenyl)sulfonyl-4-methyl-5-(1,3,4,5-tetrahydro-2-benzazepine-2-carbonyl)-1H-pyrrole-2-carboxamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N3CCCC4=CC=CC=C4C3)C(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N3CCCC4=CC=CC=C4C3)C(=O)N)C

InChI

InChI=1S/C25H27N3O4S/c1-15-11-16(2)13-20(12-15)33(31,32)23-17(3)21(27-22(23)24(26)29)25(30)28-10-6-9-18-7-4-5-8-19(18)14-28/h4-5,7-8,11-13,27H,6,9-10,14H2,1-3H3,(H2,26,29)