methyl 2-[3-azanyl-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-4-yl]ethanoate

Systemtic Name: methyl 2-[3-azanyl-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-1,2,4-triazol-4-yl]ethanoate Openeye Name: methyl 2-[3-amino-5-(2-ethoxy-2-oxo-ethyl)sulfanyl-1,2,4-triazol-4-yl]acetate CAS Name: 2-[3-amino-5-[(2-ethoxy-2-oxoethyl)thio]-1,2,4-triazol-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-amino-5-(2-ethoxy-2-oxoethyl)sulfanyl-1,2,4-triazol-4-yl]acetate Traditional Name: 2-[3-amino-5-[(2-ethoxy-2-keto-ethyl)thio]-1,2,4-triazol-4-yl]acetic acid methyl ester Formula: C9H14N4O4S MolecularWeight: 274.29686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(N1CC(=O)OC)N

Isomeric SMILES

CCOC(=O)CSC1=NN=C(N1CC(=O)OC)N

InChI

InChI=1S/C9H14N4O4S/c1-3-17-7(15)5-18-9-12-11-8(10)13(9)4-6(14)16-2/h3-5H2,1-2H3,(H2,10,11)