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

Systemtic Name: methyl 2-[(2-chloranyl-4-nitro-phenyl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(2-chloro-4-nitro-benzoyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-4-nitrobenzoyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(2-chloro-4-nitro-benzoyl)amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C13H10ClN3O5S MolecularWeight: 355.7536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)OC

InChI

InChI=1S/C13H10ClN3O5S/c1-6-10(12(19)22-2)23-13(15-6)16-11(18)8-4-3-7(17(20)21)5-9(8)14/h3-5H,1-2H3,(H,15,16,18)