[4-[(Z)-N-[2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate

Systemtic Name: [4-[(Z)-N-[2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate Openeye Name: [4-[(Z)-N-[[2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-C-methyl-carbonimidoyl]phenyl] acetate CAS Name: acetic acid [4-[(1Z)-1-[[2-[[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [4-[(Z)-N-[[2-[[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-C-methylcarbonimidoyl]phenyl] acetate Traditional Name: acetic acid [4-[(Z)-N-[[2-[[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]-C-methyl-carbonimidoyl]phenyl] ester Formula: C21H19ClN4O3S3 MolecularWeight: 507.04856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NN=C(S1)SCC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

C/C(=N/NC(=O)CSC1=NN=C(S1)SCC2=CC=C(C=C2)Cl)/C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C21H19ClN4O3S3/c1-13(16-5-9-18(10-6-16)29-14(2)27)23-24-19(28)12-31-21-26-25-20(32-21)30-11-15-3-7-17(22)8-4-15/h3-10H,11-12H2,1-2H3,(H,24,28)/b23-13-