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

Systemtic Name: ethyl 5-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-[(5-chloro-2-nitro-benzoyl)amino]-3-methyl-isothiazole-4-carboxylate CAS Name: 5-[[(5-chloro-2-nitrophenyl)-oxomethyl]amino]-3-methyl-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(5-chloro-2-nitrobenzoyl)amino]-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-[(5-chloro-2-nitro-benzoyl)amino]-3-methyl-isothiazole-4-carboxylic acid ethyl ester Formula: C14H12ClN3O5S MolecularWeight: 369.78018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClN3O5S/c1-3-23-14(20)11-7(2)17-24-13(11)16-12(19)9-6-8(15)4-5-10(9)18(21)22/h4-6H,3H2,1-2H3,(H,16,19)