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

Systemtic Name: 4-[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]-N-(4-ethoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)-N-(4-ethoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]-N-(4-ethoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(5-benzyl-2,6-dimethylpyrimidin-4-yl)-N-(4-ethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)-N-p-phenetyl-piperazine-1-carboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=CC=C4)C)C

InChI

InChI=1S/C26H31N5O2/c1-4-33-23-12-10-22(11-13-23)29-26(32)31-16-14-30(15-17-31)25-24(19(2)27-20(3)28-25)18-21-8-6-5-7-9-21/h5-13H,4,14-18H2,1-3H3,(H,29,32)