4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]-N-(2-ethoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]-N-(2-ethoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]-N-(2-ethoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)-4-pyrimidinyl]-N-(2-ethoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]-N-(2-ethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]-N-o-phenetyl-piperazine-1-carboxamide Formula: C31H32ClN5O2 MolecularWeight: 542.07108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H32ClN5O2/c1-3-39-28-12-8-7-11-27(28)34-31(38)37-19-17-36(18-20-37)30-26(21-23-9-5-4-6-10-23)22(2)33-29(35-30)24-13-15-25(32)16-14-24/h4-16H,3,17-21H2,1-2H3,(H,34,38)