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

Systemtic Name: N-ethyl-4-[6-methyl-2-(3-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-[5-benzyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide CAS Name: N-ethyl-4-[6-methyl-2-(3-methylphenyl)-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]-N-ethylpiperazine-1-carboxamide Traditional Name: 4-[5-benzyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3)C)C4=CC(=CC=C4)C

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC=C3)C)C4=CC(=CC=C4)C

InChI

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