3-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylcarbamothioyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylcarbamothioyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl-(phenylcarbamothioyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[anilino(sulfanylidene)methyl]-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl-(phenylcarbamothioyl)amino]propyl-dimethylazanium Traditional Name: 3-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl-(phenylthiocarbamoyl)amino]propyl-dimethyl-ammonium Formula: C23H29N4O2S+ MolecularWeight: 425.56696

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(CC1=CC2=C(C=C(C=C2)OC)NC1=O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCN(CC1=CC2=C(C=C(C=C2)OC)NC1=O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O2S/c1-26(2)12-7-13-27(23(30)24-19-8-5-4-6-9-19)16-18-14-17-10-11-20(29-3)15-21(17)25-22(18)28/h4-6,8-11,14-15H,7,12-13,16H2,1-3H3,(H,24,30)(H,25,28)/p+1