[2-[[2-ethoxycarbonyl-5-(4-fluorophenyl)thiophen-3-yl]amino]-2-oxidanylidene-ethyl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [2-[[2-ethoxycarbonyl-5-(4-fluorophenyl)thiophen-3-yl]amino]-2-oxidanylidene-ethyl] 2-chloranylpyridine-3-carboxylate Openeye Name: [2-[[2-ethoxycarbonyl-5-(4-fluorophenyl)-3-thienyl]amino]-2-oxo-ethyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [2-[[2-ethoxycarbonyl-5-(4-fluorophenyl)-3-thiophenyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-ethoxycarbonyl-5-(4-fluorophenyl)thiophen-3-yl]amino]-2-oxoethyl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [2-[[2-carbethoxy-5-(4-fluorophenyl)-3-thienyl]amino]-2-keto-ethyl] ester Formula: C21H16ClFN2O5S MolecularWeight: 462.878543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)F)NC(=O)COC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)F)NC(=O)COC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C21H16ClFN2O5S/c1-2-29-21(28)18-15(10-16(31-18)12-5-7-13(23)8-6-12)25-17(26)11-30-20(27)14-4-3-9-24-19(14)22/h3-10H,2,11H2,1H3,(H,25,26)