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

Systemtic Name: tert-butyl 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C15H18N2O2S3 MolecularWeight: 354.51062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)OC(C)(C)C

InChI

InChI=1S/C15H18N2O2S3/c1-10-7-5-6-8-11(10)17-14(20)22-13(16-17)21-9-12(18)19-15(2,3)4/h5-8H,9H2,1-4H3