N-[5-sulfanylidene-4-(2,4,6-trimethylphenyl)sulfonyl-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-sulfanylidene-4-(2,4,6-trimethylphenyl)sulfonyl-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-thioxo-4-(2,4,6-trimethylphenyl)sulfonyl-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-sulfanylidene-4-(2,4,6-trimethylphenyl)sulfonyl-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-sulfanylidene-4-(2,4,6-trimethylphenyl)sulfonyl-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-(4-mesitylsulfonyl-5-thioxo-1,3,4-thiadiazol-2-yl)acetamide Formula: C13H15N3O3S3 MolecularWeight: 357.4715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C(=S)SC(=N2)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C(=S)SC(=N2)NC(=O)C)C

InChI

InChI=1S/C13H15N3O3S3/c1-7-5-8(2)11(9(3)6-7)22(18,19)16-13(20)21-12(15-16)14-10(4)17/h5-6H,1-4H3,(H,14,15,17)