2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]thio]acetic acid IUPAC Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(m-toluidino)-1,3,4-thiadiazol-2-yl]thio]acetic acid Formula: C11H11N3O2S2 MolecularWeight: 281.35394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC(=O)O

InChI

InChI=1S/C11H11N3O2S2/c1-7-3-2-4-8(5-7)12-10-13-14-11(18-10)17-6-9(15)16/h2-5H,6H2,1H3,(H,12,13)(H,15,16)