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

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-piperidin-1-yl)-2-oxidanylidene-ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-1-piperidyl)-2-oxo-acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-(4-cyano-4-phenyl-1-piperidinyl)-2-oxoacetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-(4-cyano-4-phenylpiperidin-1-yl)-2-oxoacetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-piperidino)-2-keto-acetamide Formula: C28H29N7O3 MolecularWeight: 511.57496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N7O3/c1-20(36)30-14-15-31-23-18-24(33-25(32-23)21-8-4-2-5-9-21)34-26(37)27(38)35-16-12-28(19-29,13-17-35)22-10-6-3-7-11-22/h2-11,18H,12-17H2,1H3,(H,30,36)(H2,31,32,33,34,37)