methyl 2,4-dimethyl-5-[(2S)-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[(2S)-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[(2S)-2-[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-1-oxo-2-[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[(2S)-2-[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-[2-(pyrrolidine-1-carbothioylthio)acetyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H24N2O5S2 MolecularWeight: 412.52356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CSC(=S)N2CCCC2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC(=O)CSC(=S)N2CCCC2

InChI

InChI=1S/C18H24N2O5S2/c1-10-14(17(23)24-4)11(2)19-15(10)16(22)12(3)25-13(21)9-27-18(26)20-7-5-6-8-20/h12,19H,5-9H2,1-4H3/t12-/m0/s1