4-methyl-N-[6-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[6-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]benzenesulfonamide Openeye Name: N-[6-(4-benzylpiperazin-1-yl)-3-pyridyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[6-[4-(phenylmethyl)-1-piperazinyl]-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[6-(4-benzylpiperazin-1-yl)pyridin-3-yl]-4-methylbenzenesulfonamide Traditional Name: N-[6-(4-benzylpiperazino)-3-pyridyl]-4-methyl-benzenesulfonamide Formula: C23H26N4O2S MolecularWeight: 422.54314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-19-7-10-22(11-8-19)30(28,29)25-21-9-12-23(24-17-21)27-15-13-26(14-16-27)18-20-5-3-2-4-6-20/h2-12,17,25H,13-16,18H2,1H3