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

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-piperidin-1-yl)ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-1-piperidyl)acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-(4-cyano-4-phenyl-1-piperidinyl)acetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-(4-cyano-4-phenylpiperidin-1-yl)acetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-cyano-4-phenyl-piperidino)acetamide Formula: C28H31N7O2 MolecularWeight: 497.59144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCC(CC2)(C#N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCC(CC2)(C#N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N7O2/c1-21(36)30-14-15-31-24-18-25(34-27(33-24)22-8-4-2-5-9-22)32-26(37)19-35-16-12-28(20-29,13-17-35)23-10-6-3-7-11-23/h2-11,18H,12-17,19H2,1H3,(H,30,36)(H2,31,32,33,34,37)