4-(2-methylimidazol-1-yl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 4-(2-methylimidazol-1-yl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-(2-methylimidazol-1-yl)pyrimidine CAS Name: 4-(2-methyl-1-imidazolyl)-6-[4-(phenylmethyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-(2-methylimidazol-1-yl)pyrimidine Traditional Name: 4-(4-benzylsulfonylpiperazino)-6-(2-methylimidazol-1-yl)pyrimidine Formula: C19H22N6O2S MolecularWeight: 398.48198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC=CN1C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N6O2S/c1-16-20-7-8-25(16)19-13-18(21-15-22-19)23-9-11-24(12-10-23)28(26,27)14-17-5-3-2-4-6-17/h2-8,13,15H,9-12,14H2,1H3