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

Systemtic Name: N-(2,3-dimethylphenyl)-4-[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)-N-(2,3-dimethylphenyl)piperazine-1-carboxamide CAS Name: N-(2,3-dimethylphenyl)-4-[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-benzyl-2,6-dimethylpyrimidin-4-yl)-N-(2,3-dimethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)-N-(2,3-dimethylphenyl)piperazine-1-carboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C)C

InChI

InChI=1S/C26H31N5O/c1-18-9-8-12-24(19(18)2)29-26(32)31-15-13-30(14-16-31)25-23(20(3)27-21(4)28-25)17-22-10-6-5-7-11-22/h5-12H,13-17H2,1-4H3,(H,29,32)