N-[(Z)-4-phenylbutan-2-ylideneamino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(Z)-4-phenylbutan-2-ylideneamino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(Z)-(1-methyl-3-phenyl-propylidene)amino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(Z)-4-phenylbutan-2-ylideneamino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(Z)-4-phenylbutan-2-ylideneamino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(Z)-(1-methyl-3-phenyl-propylidene)amino]-3-piperidinosulfonyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)CCC3=CC=CC=C3

Isomeric SMILES

C/C(=N/NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)/CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-18(13-14-19-9-4-2-5-10-19)23-24-22(26)20-11-8-12-21(17-20)29(27,28)25-15-6-3-7-16-25/h2,4-5,8-12,17H,3,6-7,13-16H2,1H3,(H,24,26)/b23-18-