methyl 3-(3-azanyl-5-oxidanylidene-imidazo[2,1-c][1,2,4]triazol-6-yl)-2,4-bis(oxidanylidene)-4-pyridin-4-yl-butanoate

Systemtic Name: methyl 3-(3-azanyl-5-oxidanylidene-imidazo[2,1-c][1,2,4]triazol-6-yl)-2,4-bis(oxidanylidene)-4-pyridin-4-yl-butanoate Openeye Name: methyl 3-(3-amino-5-oxo-imidazo[2,1-c][1,2,4]triazol-6-yl)-2,4-dioxo-4-(4-pyridyl)butanoate CAS Name: 3-(3-amino-5-oxo-6-imidazo[2,1-c][1,2,4]triazolyl)-2,4-dioxo-4-pyridin-4-ylbutanoic acid methyl ester IUPAC Name: methyl 3-(3-amino-5-oxoimidazo[2,1-c][1,2,4]triazol-6-yl)-2,4-dioxo-4-pyridin-4-ylbutanoate Traditional Name: 3-(3-amino-5-keto-imidazo[2,1-c][1,2,4]triazol-6-yl)-2,4-diketo-4-(4-pyridyl)butyric acid methyl ester Formula: C14H10N6O5 MolecularWeight: 342.2664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)C(C1=NC2=NN=C(N2C1=O)N)C(=O)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C(=O)C(C1=NC2=NN=C(N2C1=O)N)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C14H10N6O5/c1-25-12(24)10(22)7(9(21)6-2-4-16-5-3-6)8-11(23)20-13(15)18-19-14(20)17-8/h2-5,7H,1H3,(H2,15,18)