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

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-(4-tosylpiperazino)pyrimidine Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C15H18N4O2S/c1-13-3-5-14(6-4-13)22(20,21)19-11-9-18(10-12-19)15-16-7-2-8-17-15/h2-8H,9-12H2,1H3