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1-[1-(6-bromanylphthalazin-1-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea
1-[1-(6-bromanylphthalazin-1-yl)piperidin-4-yl]-3-(3-methoxyphenyl)thiourea
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC(=C1)NC(=S)NC2CCN(CC2)C3=C4C=CC(=CC4=CN=N3)Br
Isomeric SMILES
COC1=CC=CC(=C1)NC(=S)NC2CCN(CC2)C3=C4C=CC(=CC4=CN=N3)Br
InChI
InChI=1S/C21H22BrN5OS/c1-28-18-4-2-3-17(12-18)25-21(29)24-16-7-9-27(10-8-16)20-19-6-5-15(22)11-14(19)13-23-26-20/h2-6,11-13,16H,7-10H2,1H3,(H2,24,25,29)
Other Product
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- 3-(3-hydroxyphenyl)propanoic acid
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