[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]acetic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]acetic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)CSC2=NN=C(S2)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C13H13N3O4S2/c1-19-9-4-2-8(3-5-9)10(17)6-20-11(18)7-21-13-16-15-12(14)22-13/h2-5H,6-7H2,1H3,(H2,14,15)