2-cyclohexylcarbothioylsulfanylethanoic acid

Systemtic Name: 2-cyclohexylcarbothioylsulfanylethanoic acid Openeye Name: 2-(cyclohexanecarbothioylsulfanyl)acetic acid CAS Name: 2-[[cyclohexyl(sulfanylidene)methyl]thio]acetic acid IUPAC Name: 2-(cyclohexanecarbothioylsulfanyl)acetic acid Traditional Name: 2-(cyclohexanecarbothioylthio)acetic acid Formula: C9H14O2S2 MolecularWeight: 218.33626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=S)SCC(=O)O

Isomeric SMILES

C1CCC(CC1)C(=S)SCC(=O)O

InChI

InChI=1S/C9H14O2S2/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h7H,1-6H2,(H,10,11)