ethyl 5-azanyl-1-(3-oxidanylidene-1,2,4-triazinan-5-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-(3-oxidanylidene-1,2,4-triazinan-5-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-(3-oxo-1,2,4-triazinan-5-yl)pyrazole-4-carboxylate CAS Name: 5-amino-1-(3-oxo-1,2,4-triazinan-5-yl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-(3-oxo-1,2,4-triazinan-5-yl)pyrazole-4-carboxylate Traditional Name: 5-amino-1-(3-keto-1,2,4-triazinan-5-yl)pyrazole-4-carboxylic acid ethyl ester Formula: C9H14N6O3 MolecularWeight: 254.24586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2CNNC(=O)N2)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2CNNC(=O)N2)N

InChI

InChI=1S/C9H14N6O3/c1-2-18-8(16)5-3-12-15(7(5)10)6-4-11-14-9(17)13-6/h3,6,11H,2,4,10H2,1H3,(H2,13,14,17)