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

Systemtic Name: dimethyl-[3-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(3-methylphenyl)carbamothioyl]amino]propyl]azanium Openeye Name: dimethyl-[3-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl-(m-tolylcarbamothioyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[[(3-methylanilino)-sulfanylidenemethyl]-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl-[(3-methylphenyl)carbamothioyl]amino]propyl]azanium Traditional Name: 3-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl-(m-tolylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C24H31N4OS+ MolecularWeight: 423.59414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC3=C(C=C(C=C3)C)NC2=O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC3=C(C=C(C=C3)C)NC2=O

InChI

InChI=1S/C24H30N4OS/c1-17-7-5-8-21(13-17)25-24(30)28(12-6-11-27(3)4)16-20-15-19-10-9-18(2)14-22(19)26-23(20)29/h5,7-10,13-15H,6,11-12,16H2,1-4H3,(H,25,30)(H,26,29)/p+1