5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-N-(2-oxidanylideneazepan-3-yl)pyrrole-3-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-N-(2-oxidanylideneazepan-3-yl)pyrrole-3-carboxamide Openeye Name: 5-(4-chlorophenyl)-2-methyl-1-(o-tolyl)-N-(2-oxoazepan-3-yl)pyrrole-3-carboxamide CAS Name: 5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-N-(2-oxo-3-azepanyl)-3-pyrrolecarboxamide IUPAC Name: 5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-N-(2-oxoazepan-3-yl)pyrrole-3-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-(2-ketoazepan-3-yl)-2-methyl-1-(o-tolyl)pyrrole-3-carboxamide Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)NC4CCCCNC4=O)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=C2C3=CC=C(C=C3)Cl)C(=O)NC4CCCCNC4=O)C

InChI

InChI=1S/C25H26ClN3O2/c1-16-7-3-4-9-22(16)29-17(2)20(15-23(29)18-10-12-19(26)13-11-18)24(30)28-21-8-5-6-14-27-25(21)31/h3-4,7,9-13,15,21H,5-6,8,14H2,1-2H3,(H,27,31)(H,28,30)