3-[(2,4-dimethoxyphenyl)carbamothioyl-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2,4-dimethoxyphenyl)carbamothioyl-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[(2,4-dimethoxyphenyl)carbamothioyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(2,4-dimethoxyanilino)-sulfanylidenemethyl]-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(2,4-dimethoxyphenyl)carbamothioyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-dimethylazanium Traditional Name: 3-[(2,4-dimethoxyphenyl)thiocarbamoyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl-dimethyl-ammonium Formula: C26H35N4O3S+ MolecularWeight: 483.6461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCC[NH+](C)C)C(=S)NC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCC[NH+](C)C)C(=S)NC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C26H34N4O3S/c1-17-8-9-18(2)24-21(17)14-19(25(31)28-24)16-30(13-7-12-29(3)4)26(34)27-22-11-10-20(32-5)15-23(22)33-6/h8-11,14-15H,7,12-13,16H2,1-6H3,(H,27,34)(H,28,31)/p+1