ethyl 3-methyl-5-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]isothiazole-4-carboxylate CAS Name: 3-methyl-5-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]isothiazole-4-carboxylic acid ethyl ester Formula: C16H17N3O6S MolecularWeight: 379.38768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)COC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H17N3O6S/c1-4-24-16(21)14-10(3)18-26-15(14)17-13(20)8-25-11-5-6-12(19(22)23)9(2)7-11/h5-7H,4,8H2,1-3H3,(H,17,20)