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

Systemtic Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-phenoxy-pyrimidine Openeye Name: 2-methyl-4-phenoxy-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-methyl-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-6-phenoxypyrimidine IUPAC Name: 2-methyl-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-phenoxypyrimidine Traditional Name: 2-methyl-4-phenoxy-6-(4-tosylpiperazino)pyrimidine Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)OC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c1-17-8-10-20(11-9-17)30(27,28)26-14-12-25(13-15-26)21-16-22(24-18(2)23-21)29-19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3