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

Systemtic Name: 4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: 4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-[6-methyl-2-(3-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-benzyl-4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NCC4=CC=CC=C4)C(C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NCC4=CC=CC=C4)C(C)C)C

InChI

InChI=1S/C27H33N5O/c1-19(2)24-21(4)29-25(23-12-8-9-20(3)17-23)30-26(24)31-13-15-32(16-14-31)27(33)28-18-22-10-6-5-7-11-22/h5-12,17,19H,13-16,18H2,1-4H3,(H,28,33)