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

Systemtic Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl benzoate Openeye Name: 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl benzoate CAS Name: benzoic acid 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]ethyl ester IUPAC Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl benzoate Traditional Name: benzoic acid 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]ethyl ester Formula: C17H14N2O2S3 MolecularWeight: 374.50026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCSC2=NN(C(=S)S2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCSC2=NN(C(=S)S2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O2S3/c20-15(13-7-3-1-4-8-13)21-11-12-23-16-18-19(17(22)24-16)14-9-5-2-6-10-14/h1-10H,11-12H2