N-[4-[(E)-3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(E)-3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxidanylidene-prop-1-enyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(E)-3-[4-(m-tolyl)piperazin-1-yl]-3-oxo-prop-1-enyl]phenyl]methanesulfonamide CAS Name: N-[4-[(E)-3-[4-(3-methylphenyl)-1-piperazinyl]-3-oxoprop-1-enyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(E)-3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxoprop-1-enyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(E)-3-keto-3-[4-(m-tolyl)piperazino]prop-1-enyl]phenyl]methanesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C21H25N3O3S/c1-17-4-3-5-20(16-17)23-12-14-24(15-13-23)21(25)11-8-18-6-9-19(10-7-18)22-28(2,26)27/h3-11,16,22H,12-15H2,1-2H3/b11-8+