ethyl 3-methyl-5-[(3-nitrophenyl)carbonylamino]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-5-[(3-nitrophenyl)carbonylamino]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-methyl-5-[(3-nitrobenzoyl)amino]isothiazole-4-carboxylate CAS Name: 3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(3-nitrobenzoyl)amino]-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-[(3-nitrobenzoyl)amino]isothiazole-4-carboxylic acid ethyl ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5S/c1-3-22-14(19)11-8(2)16-23-13(11)15-12(18)9-5-4-6-10(7-9)17(20)21/h4-7H,3H2,1-2H3,(H,15,18)