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1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-(3-methylphenyl)thiourea
1-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-(3-methylphenyl)thiourea
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=CC=C1)NC(=S)NCCC[NH+]2CCN(CC2)C3=CC=C(C=C3)OC
Isomeric SMILES
CC1=CC(=CC=C1)NC(=S)NCCC[NH+]2CCN(CC2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C22H30N4OS/c1-18-5-3-6-19(17-18)24-22(28)23-11-4-12-25-13-15-26(16-14-25)20-7-9-21(27-2)10-8-20/h3,5-10,17H,4,11-16H2,1-2H3,(H2,23,24,28)/p+1
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