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

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(4-oxidanyl-4-thiophen-2-yl-piperidin-1-yl)ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-hydroxy-4-(2-thienyl)-1-piperidyl]acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-(4-hydroxy-4-thiophen-2-yl-1-piperidinyl)acetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-(4-hydroxy-4-thiophen-2-ylpiperidin-1-yl)acetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-hydroxy-4-(2-thienyl)piperidino]acetamide Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCC(CC2)(C3=CC=CS3)O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)CN2CCC(CC2)(C3=CC=CS3)O)C4=CC=CC=C4

InChI

InChI=1S/C25H30N6O3S/c1-18(32)26-11-12-27-21-16-22(30-24(29-21)19-6-3-2-4-7-19)28-23(33)17-31-13-9-25(34,10-14-31)20-8-5-15-35-20/h2-8,15-16,34H,9-14,17H2,1H3,(H,26,32)(H2,27,28,29,30,33)