4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: 4-[5,6-dimethyl-2-(3-methylphenyl)-4-pyrimidinyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-benzyl-4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NCC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NCC4=CC=CC=C4)C)C

InChI

InChI=1S/C25H29N5O/c1-18-8-7-11-22(16-18)23-27-20(3)19(2)24(28-23)29-12-14-30(15-13-29)25(31)26-17-21-9-5-4-6-10-21/h4-11,16H,12-15,17H2,1-3H3,(H,26,31)