N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-oxidanylidene-2-(3-oxidanylpiperidin-1-yl)ethanamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-oxidanylidene-2-(3-oxidanylpiperidin-1-yl)ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(3-hydroxy-1-piperidyl)-2-oxo-acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-(3-hydroxy-1-piperidinyl)-2-oxoacetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-(3-hydroxypiperidin-1-yl)-2-oxoacetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-(3-hydroxypiperidino)-2-keto-acetamide Formula: C21H26N6O4 MolecularWeight: 426.46894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N2CCCC(C2)O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N2CCCC(C2)O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N6O4/c1-14(28)22-9-10-23-17-12-18(25-19(24-17)15-6-3-2-4-7-15)26-20(30)21(31)27-11-5-8-16(29)13-27/h2-4,6-7,12,16,29H,5,8-11,13H2,1H3,(H,22,28)(H2,23,24,25,26,30)