2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxylate

Systemtic Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxylate Openeye Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxylate CAS Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-4-quinolinecarboxylate IUPAC Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]quinoline-4-carboxylate Traditional Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]cinchoninate Formula: C13H8N3O2S2- MolecularWeight: 302.35152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)SC2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

InChI

InChI=1S/C13H9N3O2S2/c1-7-15-16-13(19-7)20-11-6-9(12(17)18)8-4-2-3-5-10(8)14-11/h2-6H,1H3,(H,17,18)/p-1