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2-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(2-ethylphenyl)carbamothioyl]amino]ethyl-dimethyl-azanium
2-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(2-ethylphenyl)carbamothioyl]amino]ethyl-dimethyl-azanium
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CC=CC=C1NC(=S)N(CC[NH+](C)C)CC2=CC3=C(C=CC(=C3)OCC)NC2=O
Isomeric SMILES
CCC1=CC=CC=C1NC(=S)N(CC[NH+](C)C)CC2=CC3=C(C=CC(=C3)OCC)NC2=O
InChI
InChI=1S/C25H32N4O2S/c1-5-18-9-7-8-10-22(18)27-25(32)29(14-13-28(3)4)17-20-15-19-16-21(31-6-2)11-12-23(19)26-24(20)30/h7-12,15-16H,5-6,13-14,17H2,1-4H3,(H,26,30)(H,27,32)/p+1
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- 4-[(2-chlorophenyl)methyl]-N-(3-fluorophenyl)-4-(hydroxymethyl)piperidine-1-carboxamide
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