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3-cyclohexyl-1-[(3,4-dimethoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea
3-cyclohexyl-1-[(3,4-dimethoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCC3)OC
Isomeric SMILES
COC1=C(C=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3CCCCC3)OC
InChI
InChI=1S/C22H29N3O2S/c1-26-20-11-10-17(13-21(20)27-2)15-25(16-18-7-6-12-23-14-18)22(28)24-19-8-4-3-5-9-19/h6-7,10-14,19H,3-5,8-9,15-16H2,1-2H3,(H,24,28)
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