5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 5-[(3-fluorophenyl)methyl]-2,4-dimethyl-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 5-(3-fluorobenzyl)-2,4-dimethyl-6-(4-tosylpiperazino)pyrimidine Formula: C24H27FN4O2S MolecularWeight: 454.560183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC(=CC=C4)F)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC(=CC=C4)F)C)C

InChI

InChI=1S/C24H27FN4O2S/c1-17-7-9-22(10-8-17)32(30,31)29-13-11-28(12-14-29)24-23(18(2)26-19(3)27-24)16-20-5-4-6-21(25)15-20/h4-10,15H,11-14,16H2,1-3H3