3-[[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(p-tolylmethyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(4-methylphenyl)methyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(4-methylphenyl)methyl]carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl-(4-methylbenzyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C26H35N4OS+ MolecularWeight: 451.6473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC3=CC(=C(C=C3NC2=O)C)C)C(=S)NCCC[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC3=CC(=C(C=C3NC2=O)C)C)C(=S)NCCC[NH+](C)C

InChI

InChI=1S/C26H34N4OS/c1-18-7-9-21(10-8-18)16-30(26(32)27-11-6-12-29(4)5)17-23-15-22-13-19(2)20(3)14-24(22)28-25(23)31/h7-10,13-15H,6,11-12,16-17H2,1-5H3,(H,27,32)(H,28,31)/p+1