2-[(2,4-dimethylphenyl)carbamothioyl-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2,4-dimethylphenyl)carbamothioyl-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2,4-dimethylphenyl)carbamothioyl-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2,4-dimethylanilino)-sulfanylidenemethyl]-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2,4-dimethylphenyl)carbamothioyl-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2,4-dimethylphenyl)thiocarbamoyl-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-ammonium Formula: C24H31N4O2S+ MolecularWeight: 439.59354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O2S/c1-16-6-8-21(17(2)12-16)26-24(31)28(11-10-27(3)4)15-19-13-18-14-20(30-5)7-9-22(18)25-23(19)29/h6-9,12-14H,10-11,15H2,1-5H3,(H,25,29)(H,26,31)/p+1