2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(4-benzylpiperazino)-2-[(4,6-dimethylpyrimidin-2-yl)thio]ethanone Formula: C19H24N4OS MolecularWeight: 356.48506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H24N4OS/c1-15-12-16(2)21-19(20-15)25-14-18(24)23-10-8-22(9-11-23)13-17-6-4-3-5-7-17/h3-7,12H,8-11,13-14H2,1-2H3