4-(thiophen-3-ylmethylcarbamothioylsulfanyl)butanoic acid

Systemtic Name: 4-(thiophen-3-ylmethylcarbamothioylsulfanyl)butanoic acid Openeye Name: 4-(3-thienylmethylcarbamothioylsulfanyl)butanoic acid CAS Name: 4-[[sulfanylidene-(3-thiophenylmethylamino)methyl]thio]butanoic acid IUPAC Name: 4-(thiophen-3-ylmethylcarbamothioylsulfanyl)butanoic acid Traditional Name: 4-(3-thenylthiocarbamoylthio)butyric acid Formula: C10H13NO2S3 MolecularWeight: 275.41072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1CNC(=S)SCCCC(=O)O

Isomeric SMILES

C1=CSC=C1CNC(=S)SCCCC(=O)O

InChI

InChI=1S/C10H13NO2S3/c12-9(13)2-1-4-16-10(14)11-6-8-3-5-15-7-8/h3,5,7H,1-2,4,6H2,(H,11,14)(H,12,13)