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

Systemtic Name: 3-[[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine Openeye Name: N-benzyl-3-[[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine CAS Name: 3-[[4-(2-methylsulfonylphenyl)sulfonyl-1-piperazinyl]methyl]-N-(phenylmethyl)-2-pyridinamine IUPAC Name: N-benzyl-3-[[4-(2-methylsulfonylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Traditional Name: benzyl-[3-[[4-(2-mesylphenyl)sulfonylpiperazino]methyl]-2-pyridyl]amine Formula: C24H28N4O4S2 MolecularWeight: 500.63352

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O4S2/c1-33(29,30)22-11-5-6-12-23(22)34(31,32)28-16-14-27(15-17-28)19-21-10-7-13-25-24(21)26-18-20-8-3-2-4-9-20/h2-13H,14-19H2,1H3,(H,25,26)