4-(azepan-1-ylsulfonyl)-N-(2-phenyl-3H-isoindol-1-ylidene)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(2-phenyl-3H-isoindol-1-ylidene)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2-phenylisoindolin-1-ylidene)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(2-phenyl-3H-isoindol-1-ylidene)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2-phenyl-3H-isoindol-1-ylidene)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2-phenylisoindolin-1-ylidene)benzamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3C4=CC=CC=C4CN3C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3C4=CC=CC=C4CN3C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O3S/c31-27(21-14-16-24(17-15-21)34(32,33)29-18-8-1-2-9-19-29)28-26-25-13-7-6-10-22(25)20-30(26)23-11-4-3-5-12-23/h3-7,10-17H,1-2,8-9,18-20H2