4-[(E)-3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]prop-1-enyl]-N-propyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]prop-1-enyl]-N-propyl-benzenesulfonamide Openeye Name: 4-[(E)-3-(4-benzylpiperazin-1-yl)-3-oxo-prop-1-enyl]-N-propyl-benzenesulfonamide CAS Name: 4-[(E)-3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]prop-1-enyl]-N-propylbenzenesulfonamide IUPAC Name: 4-[(E)-3-(4-benzylpiperazin-1-yl)-3-oxoprop-1-enyl]-N-propylbenzenesulfonamide Traditional Name: 4-[(E)-3-(4-benzylpiperazino)-3-keto-prop-1-enyl]-N-propyl-benzenesulfonamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-2-14-24-30(28,29)22-11-8-20(9-12-22)10-13-23(27)26-17-15-25(16-18-26)19-21-6-4-3-5-7-21/h3-13,24H,2,14-19H2,1H3/b13-10+