1-(4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-piperidin-1-ium-1-yl-ethanone

Systemtic Name: 1-(4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-piperidin-1-ium-1-yl-ethanone Openeye Name: 1-(4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-2-piperidin-1-ium-1-yl-ethanone CAS Name: 1-(4,4-dimethyl-1-sulfanylidene-5-dithiolo[3,4-c]quinolinyl)-2-(1-piperidin-1-iumyl)ethanone IUPAC Name: 1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-piperidin-1-ium-1-ylethanone Traditional Name: 1-(4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-2-piperidin-1-ium-1-yl-ethanone Formula: C19H23N2OS3+ MolecularWeight: 391.59372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C3=CC=CC=C3N1C(=O)C[NH+]4CCCCC4)C(=S)SS2)C

Isomeric SMILES

CC1(C2=C(C3=CC=CC=C3N1C(=O)C[NH+]4CCCCC4)C(=S)SS2)C

InChI

InChI=1S/C19H22N2OS3/c1-19(2)17-16(18(23)25-24-17)13-8-4-5-9-14(13)21(19)15(22)12-20-10-6-3-7-11-20/h4-5,8-9H,3,6-7,10-12H2,1-2H3/p+1