methyl 1-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[(5-chloro-2-thienyl)methylthio]acetyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C13H16ClNO3S2 MolecularWeight: 333.85404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

COC(=O)C1CCCN1C(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C13H16ClNO3S2/c1-18-13(17)10-3-2-6-15(10)12(16)8-19-7-9-4-5-11(14)20-9/h4-5,10H,2-3,6-8H2,1H3