methyl 3-(1,2,3-thiadiazol-4-ylmethylamino)benzoate

Systemtic Name: methyl 3-(1,2,3-thiadiazol-4-ylmethylamino)benzoate Openeye Name: methyl 3-(thiadiazol-4-ylmethylamino)benzoate CAS Name: 3-(4-thiadiazolylmethylamino)benzoic acid methyl ester IUPAC Name: methyl 3-(thiadiazol-4-ylmethylamino)benzoate Traditional Name: 3-(thiadiazol-4-ylmethylamino)benzoic acid methyl ester Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NCC2=CSN=N2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NCC2=CSN=N2

InChI

InChI=1S/C11H11N3O2S/c1-16-11(15)8-3-2-4-9(5-8)12-6-10-7-17-14-13-10/h2-5,7,12H,6H2,1H3