[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 4-methyl-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 4-methyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 4-methylthiadiazole-5-carboxylate CAS Name: 4-methyl-5-thiadiazolecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 4-methylthiadiazole-5-carboxylate Traditional Name: 4-methylthiadiazole-5-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)OCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(SN=N1)C(=O)OCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3S/c1-9-12(20-16-15-9)13(18)19-8-11(17)14-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,14,17)