2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid

Systemtic Name: 2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid Openeye Name: 2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid CAS Name: 2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid IUPAC Name: 2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid Traditional Name: 2-[(5-acetamido-1,3,4-thiadiazol-2-yl)methylamino]benzoic acid Formula: C12H12N4O3S MolecularWeight: 292.31368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(S1)CNC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=O)NC1=NN=C(S1)CNC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C12H12N4O3S/c1-7(17)14-12-16-15-10(20-12)6-13-9-5-3-2-4-8(9)11(18)19/h2-5,13H,6H2,1H3,(H,18,19)(H,14,16,17)