3-[[cyclopentyl-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[cyclopentyl-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[cyclopentyl-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[cyclopentyl-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[cyclopentyl-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[cyclopentyl-[(2-keto-6,8-dimethyl-1H-quinolin-3-yl)methyl]thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C23H35N4OS+ MolecularWeight: 415.6152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NCCC[NH+](C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=O)N2)CN(C3CCCC3)C(=S)NCCC[NH+](C)C)C

InChI

InChI=1S/C23H34N4OS/c1-16-12-17(2)21-18(13-16)14-19(22(28)25-21)15-27(20-8-5-6-9-20)23(29)24-10-7-11-26(3)4/h12-14,20H,5-11,15H2,1-4H3,(H,24,29)(H,25,28)/p+1