3-chloranyl-1-[4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 3-chloranyl-1-[4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 3-chloro-1-[4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 3-chloro-1-[4-[5-ethyl-6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-2,2-dimethyl-1-propanone IUPAC Name: 3-chloro-1-[4-[5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 3-chloro-1-[4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]-2,2-dimethyl-propan-1-one Formula: C23H31ClN4O MolecularWeight: 414.97144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C(C)(C)CCl)C3=CC(=CC=C3)C)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C(C)(C)CCl)C3=CC(=CC=C3)C)C

InChI

InChI=1S/C23H31ClN4O/c1-6-19-17(3)25-20(18-9-7-8-16(2)14-18)26-21(19)27-10-12-28(13-11-27)22(29)23(4,5)15-24/h7-9,14H,6,10-13,15H2,1-5H3