3-[[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine

Systemtic Name: 3-[[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine Openeye Name: N-benzyl-3-[[4-(m-tolylsulfonyl)piperazin-1-yl]methyl]pyridin-2-amine CAS Name: 3-[[4-(3-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-(phenylmethyl)-2-pyridinamine IUPAC Name: N-benzyl-3-[[4-(3-methylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Traditional Name: benzyl-[3-[[4-(m-tolylsulfonyl)piperazino]methyl]-2-pyridyl]amine Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2S/c1-20-7-5-11-23(17-20)31(29,30)28-15-13-27(14-16-28)19-22-10-6-12-25-24(22)26-18-21-8-3-2-4-9-21/h2-12,17H,13-16,18-19H2,1H3,(H,25,26)