N-(4-methylphenyl)-N-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: N-(4-methylphenyl)-N-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: N-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-N-(p-tolyl)benzenesulfonamide CAS Name: N-(4-methylphenyl)-N-[3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: N-(4-methylphenyl)-N-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: N-[3-keto-3-[4-(2-pyrimidyl)piperazino]propyl]-N-(p-tolyl)benzenesulfonamide Formula: C24H27N5O3S MolecularWeight: 465.56788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N5O3S/c1-20-8-10-21(11-9-20)29(33(31,32)22-6-3-2-4-7-22)15-12-23(30)27-16-18-28(19-17-27)24-25-13-5-14-26-24/h2-11,13-14H,12,15-19H2,1H3