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

Systemtic Name: 3-methyl-4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: 3-methyl-4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-methyl-4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-oxoethyl]amino]benzoate IUPAC Name: 3-methyl-4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 3-methyl-4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl]amino]benzoate Formula: C13H12N3O3S2- MolecularWeight: 322.38268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CSC2=NN=C(S2)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CSC2=NN=C(S2)C

InChI

InChI=1S/C13H13N3O3S2/c1-7-5-9(12(18)19)3-4-10(7)14-11(17)6-20-13-16-15-8(2)21-13/h3-5H,6H2,1-2H3,(H,14,17)(H,18,19)/p-1