(2-azanyl-2-oxidanylidene-ethyl) 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=CS2)C(=O)OCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=CS2)C(=O)OCC(=O)N

InChI

InChI=1S/C13H13N3O3S/c14-11(17)7-19-12(18)10-8-20-13(16-10)15-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,14,17)(H,15,16)