N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-2-[[4-(4-fluorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[4-(2,5-dimethylphenyl)-2-thiazolyl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-2-[[4-(4-fluorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C21H17FN4OS4 MolecularWeight: 488.644283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)CSC3=NN(C(=S)S3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=N2)NC(=O)CSC3=NN(C(=S)S3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4OS4/c1-12-3-4-13(2)16(9-12)17-10-29-19(23-17)24-18(27)11-30-20-25-26(21(28)31-20)15-7-5-14(22)6-8-15/h3-10H,11H2,1-2H3,(H,23,24,27)