N-(3,4-dimethylphenyl)-4-[6-ethyl-2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-[6-ethyl-2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide CAS Name: N-(3,4-dimethylphenyl)-4-[6-ethyl-2-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-benzyl-6-ethyl-2-methylpyrimidin-4-yl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)C)C)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC(=C(C=C3)C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H33N5O/c1-5-25-24(18-22-9-7-6-8-10-22)26(29-21(4)28-25)31-13-15-32(16-14-31)27(33)30-23-12-11-19(2)20(3)17-23/h6-12,17H,5,13-16,18H2,1-4H3,(H,30,33)