methyl-(2-oxidanylideneethylidene)-(1-quinolin-3-ylcyclohexyl)carbothioyl-azanium

Systemtic Name: methyl-(2-oxidanylideneethylidene)-(1-quinolin-3-ylcyclohexyl)carbothioyl-azanium Openeye Name: methyl-(2-oxoethylidene)-[1-(3-quinolyl)cyclohexanecarbothioyl]ammonium CAS Name: methyl-(2-oxoethylidene)-[[1-(3-quinolinyl)cyclohexyl]-sulfanylidenemethyl]ammonium IUPAC Name: methyl-(2-oxoethylidene)-(1-quinolin-3-ylcyclohexanecarbothioyl)azanium Traditional Name: 2-ketoethylidene-methyl-[1-(3-quinolyl)cyclohexanecarbothioyl]ammonium Formula: C19H21N2OS+ MolecularWeight: 325.44784

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CC=O)C(=S)C1(CCCCC1)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C[N+](=CC=O)C(=S)C1(CCCCC1)C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C19H21N2OS/c1-21(11-12-22)18(23)19(9-5-2-6-10-19)16-13-15-7-3-4-8-17(15)20-14-16/h3-4,7-8,11-14H,2,5-6,9-10H2,1H3/q+1