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

Systemtic Name: ethyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Openeye Name: ethyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate CAS Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate Traditional Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]butyric acid ethyl ester Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)SC1=NN=C(S1)C2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)OCC)SC1=NN=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O2S2/c1-3-11(13(17)18-4-2)19-14-16-15-12(20-14)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3