2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]pyrimidine Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2S/c1-13-4-5-15(12-14(13)2)23(21,22)20-10-8-19(9-11-20)16-17-6-3-7-18-16/h3-7,12H,8-11H2,1-2H3