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

Systemtic Name: N-[4-[(E)-3-oxidanylidene-3-(4-phenethylpiperazin-1-yl)prop-1-enyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(E)-3-oxo-3-(4-phenethylpiperazin-1-yl)prop-1-enyl]phenyl]methanesulfonamide CAS Name: N-[4-[(E)-3-oxo-3-(4-phenethyl-1-piperazinyl)prop-1-enyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(E)-3-oxo-3-(4-phenethylpiperazin-1-yl)prop-1-enyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(E)-3-keto-3-(4-phenethylpiperazino)prop-1-enyl]phenyl]methanesulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-29(27,28)23-21-10-7-20(8-11-21)9-12-22(26)25-17-15-24(16-18-25)14-13-19-5-3-2-4-6-19/h2-12,23H,13-18H2,1H3/b12-9+