tert-butyl 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoate Openeye Name: tert-butyl 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]acetate CAS Name: 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]acetic acid tert-butyl ester Formula: C14H16N2O2S3 MolecularWeight: 340.48404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN(C(=S)S1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN(C(=S)S1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O2S3/c1-14(2,3)18-11(17)9-20-12-15-16(13(19)21-12)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3