ethyl 2-oxidanylidene-4-phenyl-6-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-4-phenyl-6-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-4-phenyl-6-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[oxo-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methoxy]methyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-4-phenyl-6-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-phenyl-6-[[2-(1,2,4-triazol-1-yl)nicotinoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N6O5 MolecularWeight: 448.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C22H20N6O5/c1-2-32-21(30)17-16(26-22(31)27-18(17)14-7-4-3-5-8-14)11-33-20(29)15-9-6-10-24-19(15)28-13-23-12-25-28/h3-10,12-13,18H,2,11H2,1H3,(H2,26,27,31)