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

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 5-amino-3-methyl-isothiazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isothiazolecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 5-amino-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isothiazole-4-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC(=O)NCC2=CC=CC=C2)N

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC(=O)NCC2=CC=CC=C2)N

InChI

InChI=1S/C14H15N3O3S/c1-9-12(13(15)21-17-9)14(19)20-8-11(18)16-7-10-5-3-2-4-6-10/h2-6H,7-8,15H2,1H3,(H,16,18)