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

Systemtic Name: 1-(4-tert-butylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(4-tert-butylphenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]ethanone Formula: C20H20N2OS3 MolecularWeight: 400.5806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN(C(=S)S2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN(C(=S)S2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2OS3/c1-20(2,3)15-11-9-14(10-12-15)17(23)13-25-18-21-22(19(24)26-18)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3