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

Systemtic Name: N-(phenylmethyl)-3-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Openeye Name: N-benzyl-3-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine CAS Name: N-(phenylmethyl)-3-[[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]-2-pyridinamine IUPAC Name: N-benzyl-3-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Traditional Name: benzyl-[3-[[4-(4-propylphenyl)sulfonylpiperazino]methyl]-2-pyridyl]amine Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(N=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-2-7-22-11-13-25(14-12-22)33(31,32)30-18-16-29(17-19-30)21-24-10-6-15-27-26(24)28-20-23-8-4-3-5-9-23/h3-6,8-15H,2,7,16-21H2,1H3,(H,27,28)