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

Systemtic Name: ethyl 2-[[2-(2-methoxyethylamino)-5-nitro-phenyl]carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(2-methoxyethylamino)-5-nitro-benzoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[2-(2-methoxyethylamino)-5-nitrophenyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-methoxyethylamino)-5-nitrobenzoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(2-methoxyethylamino)-5-nitro-benzoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC)C

InChI

InChI=1S/C17H20N4O6S/c1-4-27-16(23)14-10(2)19-17(28-14)20-15(22)12-9-11(21(24)25)5-6-13(12)18-7-8-26-3/h5-6,9,18H,4,7-8H2,1-3H3,(H,19,20,22)