[3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxidanylidene-piperidin-4-yl]oxymethanedithioic acid

Systemtic Name: [3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxidanylidene-piperidin-4-yl]oxymethanedithioic acid Openeye Name: [3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-4-piperidyl]oxymethanedithioic acid CAS Name: [3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-4-piperidinyl]oxymethanedithioic acid IUPAC Name: [3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxopiperidin-4-yl]oxymethanedithioic acid Traditional Name: [3,3-diethyl-1-[2-(1H-indol-3-yl)ethyl]-2-keto-4-piperidyl]oxymethanedithioic acid Formula: C20H26N2O2S2 MolecularWeight: 390.56264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCN(C1=O)CCC2=CNC3=CC=CC=C32)OC(=S)S)CC

Isomeric SMILES

CCC1(C(CCN(C1=O)CCC2=CNC3=CC=CC=C32)OC(=S)S)CC

InChI

InChI=1S/C20H26N2O2S2/c1-3-20(4-2)17(24-19(25)26)10-12-22(18(20)23)11-9-14-13-21-16-8-6-5-7-15(14)16/h5-8,13,17,21H,3-4,9-12H2,1-2H3,(H,25,26)