4-(cyclohexylmethylcarbamothioylsulfanyl)butanoic acid

Systemtic Name: 4-(cyclohexylmethylcarbamothioylsulfanyl)butanoic acid Openeye Name: 4-(cyclohexylmethylcarbamothioylsulfanyl)butanoic acid CAS Name: 4-[[(cyclohexylmethylamino)-sulfanylidenemethyl]thio]butanoic acid IUPAC Name: 4-(cyclohexylmethylcarbamothioylsulfanyl)butanoic acid Traditional Name: 4-(cyclohexylmethylthiocarbamoylthio)butyric acid Formula: C12H21NO2S2 MolecularWeight: 275.43064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=S)SCCCC(=O)O

Isomeric SMILES

C1CCC(CC1)CNC(=S)SCCCC(=O)O

InChI

InChI=1S/C12H21NO2S2/c14-11(15)7-4-8-17-12(16)13-9-10-5-2-1-3-6-10/h10H,1-9H2,(H,13,16)(H,14,15)