N-[4-[(E)-3-oxidanylidene-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]prop-1-enyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(E)-3-oxidanylidene-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]prop-1-enyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(E)-3-oxo-3-[4-(2-pyridylmethyl)piperazin-1-yl]prop-1-enyl]phenyl]methanesulfonamide CAS Name: N-[4-[(E)-3-oxo-3-[4-(2-pyridinylmethyl)-1-piperazinyl]prop-1-enyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(E)-3-oxo-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]prop-1-enyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(E)-3-keto-3-[4-(2-pyridylmethyl)piperazino]prop-1-enyl]phenyl]methanesulfonamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=CC=N3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)CC3=CC=CC=N3

InChI

InChI=1S/C20H24N4O3S/c1-28(26,27)22-18-8-5-17(6-9-18)7-10-20(25)24-14-12-23(13-15-24)16-19-4-2-3-11-21-19/h2-11,22H,12-16H2,1H3/b10-7+