3-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-methoxyphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(4-methoxyphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-methoxyphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-methoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl-[(4-methoxyphenyl)methyl]carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl-p-anisyl-thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C26H35N4O4S+ MolecularWeight: 499.6455

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N(CC1=CC=C(C=C1)OC)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

Isomeric SMILES

C[NH+](C)CCCNC(=S)N(CC1=CC=C(C=C1)OC)CC2=CC3=CC(=C(C=C3NC2=O)OC)OC

InChI

InChI=1S/C26H34N4O4S/c1-29(2)12-6-11-27-26(35)30(16-18-7-9-21(32-3)10-8-18)17-20-13-19-14-23(33-4)24(34-5)15-22(19)28-25(20)31/h7-10,13-15H,6,11-12,16-17H2,1-5H3,(H,27,35)(H,28,31)/p+1