N,N-diethyl-4-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-[4-(4-ethylbenzoyl)piperazino]-3-keto-propyl]benzenesulfonamide Formula: C26H35N3O4S MolecularWeight: 485.6388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C26H35N3O4S/c1-4-21-7-12-23(13-8-21)26(31)28-19-17-27(18-20-28)25(30)16-11-22-9-14-24(15-10-22)34(32,33)29(5-2)6-3/h7-10,12-15H,4-6,11,16-20H2,1-3H3