2-[(2-methoxyphenyl)carbamothioyl-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-methoxyphenyl)carbamothioyl-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-methoxyphenyl)carbamothioyl-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-methoxyanilino)-sulfanylidenemethyl]-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-methoxyphenyl)carbamothioyl-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl-[(2-methoxyphenyl)thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C23H29N4O2S+ MolecularWeight: 425.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC[NH+](C)C)C(=S)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC[NH+](C)C)C(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C23H28N4O2S/c1-16-9-10-17-14-18(22(28)24-20(17)13-16)15-27(12-11-26(2)3)23(30)25-19-7-5-6-8-21(19)29-4/h5-10,13-14H,11-12,15H2,1-4H3,(H,24,28)(H,25,30)/p+1