methyl 4-[[5-[(2-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[5-[(2-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanoate Openeye Name: methyl 4-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxobutanoate Traditional Name: 3-keto-4-[[5-(o-anisidino)-1,3,4-thiadiazol-2-yl]thio]butyric acid methyl ester Formula: C14H15N3O4S2 MolecularWeight: 353.4166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NN=C(S2)SCC(=O)CC(=O)OC

Isomeric SMILES

COC1=CC=CC=C1NC2=NN=C(S2)SCC(=O)CC(=O)OC

InChI

InChI=1S/C14H15N3O4S2/c1-20-11-6-4-3-5-10(11)15-13-16-17-14(23-13)22-8-9(18)7-12(19)21-2/h3-6H,7-8H2,1-2H3,(H,15,16)