2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine Openeye Name: 2-methyl-4-(4-methylpiperazin-1-yl)-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-methyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-6-(4-methyl-1-piperazinyl)pyrimidine IUPAC Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine Traditional Name: 2-methyl-4-(4-methylpiperazino)-6-(4-tosylpiperazino)pyrimidine Formula: C21H30N6O2S MolecularWeight: 430.5669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4CCN(CC4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3)N4CCN(CC4)C)C

InChI

InChI=1S/C21H30N6O2S/c1-17-4-6-19(7-5-17)30(28,29)27-14-12-26(13-15-27)21-16-20(22-18(2)23-21)25-10-8-24(3)9-11-25/h4-7,16H,8-15H2,1-3H3