N-(3-ethylphenyl)-4-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-ethylphenyl)-4-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(3-ethylphenyl)-4-[6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(3-ethylphenyl)-4-[6-methyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-ethylphenyl)-4-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(3-ethylphenyl)-4-[6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H29N5O/c1-4-20-6-5-7-22(17-20)27-25(31)30-14-12-29(13-15-30)23-16-19(3)26-24(28-23)21-10-8-18(2)9-11-21/h5-11,16-17H,4,12-15H2,1-3H3,(H,27,31)