ethyl 2-[[4-(3-azanyl-1,2,4-triazol-1-yl)phenyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[[4-(3-azanyl-1,2,4-triazol-1-yl)phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[4-(3-amino-1,2,4-triazol-1-yl)anilino]-2-oxo-acetate CAS Name: 2-[4-(3-amino-1,2,4-triazol-1-yl)anilino]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-amino-1,2,4-triazol-1-yl)anilino]-2-oxoacetate Traditional Name: 2-[4-(3-amino-1,2,4-triazol-1-yl)anilino]-2-keto-acetic acid ethyl ester Formula: C12H13N5O3 MolecularWeight: 275.26332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=CC=C(C=C1)N2C=NC(=N2)N

Isomeric SMILES

CCOC(=O)C(=O)NC1=CC=C(C=C1)N2C=NC(=N2)N

InChI

InChI=1S/C12H13N5O3/c1-2-20-11(19)10(18)15-8-3-5-9(6-4-8)17-7-14-12(13)16-17/h3-7H,2H2,1H3,(H2,13,16)(H,15,18)