methyl 4-(thiophen-2-ylmethylcarbamothioylsulfanyl)butanoate

Systemtic Name: methyl 4-(thiophen-2-ylmethylcarbamothioylsulfanyl)butanoate Openeye Name: methyl 4-(2-thienylmethylcarbamothioylsulfanyl)butanoate CAS Name: 4-[[sulfanylidene-(thiophen-2-ylmethylamino)methyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-(thiophen-2-ylmethylcarbamothioylsulfanyl)butanoate Traditional Name: 4-(2-thenylthiocarbamoylthio)butyric acid methyl ester Formula: C11H15NO2S3 MolecularWeight: 289.4373

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC(=S)NCC1=CC=CS1

Isomeric SMILES

COC(=O)CCCSC(=S)NCC1=CC=CS1

InChI

InChI=1S/C11H15NO2S3/c1-14-10(13)5-3-7-17-11(15)12-8-9-4-2-6-16-9/h2,4,6H,3,5,7-8H2,1H3,(H,12,15)