3-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-ethoxyphenyl)carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-ethoxyphenyl)carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(4-ethoxyphenyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(4-ethoxyanilino)-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(4-ethoxyphenyl)carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl-(p-phenetylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C26H35N4O2S+ MolecularWeight: 467.6467

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC3=C(C=C(C=C3NC2=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CCC[NH+](C)C)CC2=CC3=C(C=C(C=C3NC2=O)C)C

InChI

InChI=1S/C26H34N4O2S/c1-6-32-22-10-8-21(9-11-22)27-26(33)30(13-7-12-29(4)5)17-20-16-23-19(3)14-18(2)15-24(23)28-25(20)31/h8-11,14-16H,6-7,12-13,17H2,1-5H3,(H,27,33)(H,28,31)/p+1