2-(3-methylpiperidin-1-yl)carbothioylsulfanylethanoic acid

Systemtic Name: 2-(3-methylpiperidin-1-yl)carbothioylsulfanylethanoic acid Openeye Name: 2-(3-methylpiperidine-1-carbothioyl)sulfanylacetic acid CAS Name: 2-[[(3-methyl-1-piperidinyl)-sulfanylidenemethyl]thio]acetic acid IUPAC Name: 2-(3-methylpiperidine-1-carbothioyl)sulfanylacetic acid Traditional Name: 2-[(3-methylpiperidine-1-carbothioyl)thio]acetic acid Formula: C9H15NO2S2 MolecularWeight: 233.3509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=S)SCC(=O)O

Isomeric SMILES

CC1CCCN(C1)C(=S)SCC(=O)O

InChI

InChI=1S/C9H15NO2S2/c1-7-3-2-4-10(5-7)9(13)14-6-8(11)12/h7H,2-6H2,1H3,(H,11,12)