N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxo-propyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[3-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-3-oxopropyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxopropyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[3-[4-(4-cyanobenzyl)piperazino]-3-keto-propyl]-2,5-dimethyl-benzenesulfonamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H28N4O3S/c1-18-3-4-19(2)22(15-18)31(29,30)25-10-9-23(28)27-13-11-26(12-14-27)17-21-7-5-20(16-24)6-8-21/h3-8,15,25H,9-14,17H2,1-2H3