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

Systemtic Name: N-tert-butyl-4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]-N-tert-butyl-piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[6-methyl-2-(4-methylphenyl)-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-[5-benzyl-6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]-N-tert-butylpiperazine-1-carboxamide Traditional Name: 4-[5-benzyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]-N-tert-butyl-piperazine-1-carboxamide Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C28H35N5O/c1-20-11-13-23(14-12-20)25-29-21(2)24(19-22-9-7-6-8-10-22)26(30-25)32-15-17-33(18-16-32)27(34)31-28(3,4)5/h6-14H,15-19H2,1-5H3,(H,31,34)