methyl 4-methyl-3-[2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[[5-(propylthio)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C16H19N3O3S3 MolecularWeight: 397.53536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CCCSC1=NN=C(S1)SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C16H19N3O3S3/c1-4-7-23-15-18-19-16(25-15)24-9-13(20)17-12-8-11(14(21)22-3)6-5-10(12)2/h5-6,8H,4,7,9H2,1-3H3,(H,17,20)