[2-[(2-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate

Systemtic Name: [2-[(2-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate Openeye Name: [2-(2-chloro-4-fluoro-anilino)-2-oxo-ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]acetic acid [2-(2-chloro-4-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-fluoroanilino)-2-oxoethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate Traditional Name: 2-(pyrrolidine-1-carbothioylthio)acetic acid [2-(2-chloro-4-fluoro-anilino)-2-keto-ethyl] ester Formula: C15H16ClFN2O3S2 MolecularWeight: 390.880543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C15H16ClFN2O3S2/c16-11-7-10(17)3-4-12(11)18-13(20)8-22-14(21)9-24-15(23)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8-9H2,(H,18,20)