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

Systemtic Name: N-(2-ethoxyphenyl)-4-[6-ethyl-2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide CAS Name: N-(2-ethoxyphenyl)-4-[6-ethyl-2-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-benzyl-6-ethyl-2-methylpyrimidin-4-yl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(5-benzyl-6-ethyl-2-methyl-pyrimidin-4-yl)-N-o-phenetyl-piperazine-1-carboxamide Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC=CC=C3OCC)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC=CC=C3OCC)CC4=CC=CC=C4

InChI

InChI=1S/C27H33N5O2/c1-4-23-22(19-21-11-7-6-8-12-21)26(29-20(3)28-23)31-15-17-32(18-16-31)27(33)30-24-13-9-10-14-25(24)34-5-2/h6-14H,4-5,15-19H2,1-3H3,(H,30,33)