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

Systemtic Name: 3-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine Openeye Name: N-benzyl-3-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine CAS Name: 3-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-N-(phenylmethyl)-2-pyridinamine IUPAC Name: N-benzyl-3-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Traditional Name: benzyl-[3-[[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methyl]-2-pyridyl]amine Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H30N4O4S/c1-32-23-11-10-22(17-24(23)33-2)34(30,31)29-15-13-28(14-16-29)19-21-9-6-12-26-25(21)27-18-20-7-4-3-5-8-20/h3-12,17H,13-16,18-19H2,1-2H3,(H,26,27)