5-[(phenylmethyl)amino]-1,2,3-thiadiazole-4-carboxylic acid

Systemtic Name: 5-[(phenylmethyl)amino]-1,2,3-thiadiazole-4-carboxylic acid Openeye Name: 5-(benzylamino)thiadiazole-4-carboxylic acid CAS Name: 5-[(phenylmethyl)amino]-4-thiadiazolecarboxylic acid IUPAC Name: 5-(benzylamino)thiadiazole-4-carboxylic acid Traditional Name: 5-(benzylamino)thiadiazole-4-carboxylic acid Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(N=NS2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(N=NS2)C(=O)O

InChI

InChI=1S/C10H9N3O2S/c14-10(15)8-9(16-13-12-8)11-6-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,14,15)