[2-[2-(4-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate

Systemtic Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate Openeye Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxo-ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]acetic acid [2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate Traditional Name: 2-(pyrrolidine-1-carbothioylthio)acetic acid [2-[2-(4-chlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C17H21ClN2O3S2 MolecularWeight: 400.94324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)OCC(=O)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H21ClN2O3S2/c18-14-5-3-13(4-6-14)7-8-19-15(21)11-23-16(22)12-25-17(24)20-9-1-2-10-20/h3-6H,1-2,7-12H2,(H,19,21)