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

Systemtic Name: [2-[(4-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylcarbothioylsulfanylethanoate Openeye Name: [2-(4-chloro-2-methyl-anilino)-2-oxo-ethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate CAS Name: 2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]acetic acid [2-(4-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-2-methylanilino)-2-oxoethyl] 2-(pyrrolidine-1-carbothioylsulfanyl)acetate Traditional Name: 2-(pyrrolidine-1-carbothioylthio)acetic acid [2-(4-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C16H19ClN2O3S2 MolecularWeight: 386.91666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)COC(=O)CSC(=S)N2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)COC(=O)CSC(=S)N2CCCC2

InChI

InChI=1S/C16H19ClN2O3S2/c1-11-8-12(17)4-5-13(11)18-14(20)9-22-15(21)10-24-16(23)19-6-2-3-7-19/h4-5,8H,2-3,6-7,9-10H2,1H3,(H,18,20)