3-(5-azanyl-1,3,4-thiadiazol-2-yl)benzoic acid

Systemtic Name: 3-(5-azanyl-1,3,4-thiadiazol-2-yl)benzoic acid Openeye Name: 3-(5-amino-1,3,4-thiadiazol-2-yl)benzoic acid CAS Name: 3-(5-amino-1,3,4-thiadiazol-2-yl)benzoic acid IUPAC Name: 3-(5-amino-1,3,4-thiadiazol-2-yl)benzoic acid Traditional Name: 3-(5-amino-1,3,4-thiadiazol-2-yl)benzoic acid Formula: C9H7N3O2S MolecularWeight: 221.23578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=NN=C(S2)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=NN=C(S2)N

InChI

InChI=1S/C9H7N3O2S/c10-9-12-11-7(15-9)5-2-1-3-6(4-5)8(13)14/h1-4H,(H2,10,12)(H,13,14)