ethyl 3-oxidanylidene-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate

Systemtic Name: ethyl 3-oxidanylidene-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Openeye Name: ethyl 3-oxo-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate CAS Name: 3-oxo-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Traditional Name: 3-keto-4-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]butyric acid ethyl ester Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=NN=C(S1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=NN=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O3S2/c1-2-19-12(18)8-11(17)9-20-14-16-15-13(21-14)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3