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

Systemtic Name: 4-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid CAS Name: 4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl]amino]benzoic acid Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H11N3O3S2/c1-7-14-15-12(20-7)19-6-10(16)13-9-4-2-8(3-5-9)11(17)18/h2-5H,6H2,1H3,(H,13,16)(H,17,18)