methyl 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C12H12N2O2S3 MolecularWeight: 312.43088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(S2)SC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(S2)SC

InChI

InChI=1S/C12H12N2O2S3/c1-16-10(15)9-5-3-8(4-6-9)7-18-12-14-13-11(17-2)19-12/h3-6H,7H2,1-2H3