1-methyl-4-[6-[4-(2-methylphenyl)piperazin-1-yl]pyridin-3-yl]sulfonyl-piperazine

Systemtic Name: 1-methyl-4-[6-[4-(2-methylphenyl)piperazin-1-yl]pyridin-3-yl]sulfonyl-piperazine Openeye Name: 1-methyl-4-[[6-[4-(o-tolyl)piperazin-1-yl]-3-pyridyl]sulfonyl]piperazine CAS Name: 1-methyl-4-[[6-[4-(2-methylphenyl)-1-piperazinyl]-3-pyridinyl]sulfonyl]piperazine IUPAC Name: 1-methyl-4-[6-[4-(2-methylphenyl)piperazin-1-yl]pyridin-3-yl]sulfonylpiperazine Traditional Name: 1-methyl-4-[[6-[4-(o-tolyl)piperazino]-3-pyridyl]sulfonyl]piperazine Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H29N5O2S/c1-18-5-3-4-6-20(18)24-11-13-25(14-12-24)21-8-7-19(17-22-21)29(27,28)26-15-9-23(2)10-16-26/h3-8,17H,9-16H2,1-2H3