N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-oxidanylidene-2-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]ethanamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-oxidanylidene-2-[4-oxidanyl-4-(phenylmethyl)piperidin-1-yl]ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-benzyl-4-hydroxy-1-piperidyl)-2-oxo-acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-2-oxoacetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-(4-benzyl-4-hydroxypiperidin-1-yl)-2-oxoacetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-benzyl-4-hydroxy-piperidino)-2-keto-acetamide Formula: C28H32N6O4 MolecularWeight: 516.59148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N2CCC(CC2)(CC3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N2CCC(CC2)(CC3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C28H32N6O4/c1-20(35)29-14-15-30-23-18-24(32-25(31-23)22-10-6-3-7-11-22)33-26(36)27(37)34-16-12-28(38,13-17-34)19-21-8-4-2-5-9-21/h2-11,18,38H,12-17,19H2,1H3,(H,29,35)(H2,30,31,32,33,36)