[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate

Systemtic Name: [2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Openeye Name: [2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl] 2-(3-thienyl)thiazole-4-carboxylate CAS Name: 2-(3-thiophenyl)-4-thiazolecarboxylic acid [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-thienyl)thiazole-4-carboxylic acid [2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C16H10FN3O5S2 MolecularWeight: 407.396103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CSC(=N2)C3=CSC=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CSC(=N2)C3=CSC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C16H10FN3O5S2/c17-11-2-1-10(5-13(11)20(23)24)18-14(21)6-25-16(22)12-8-27-15(19-12)9-3-4-26-7-9/h1-5,7-8H,6H2,(H,18,21)