3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-(2,5-dimethoxybenzyl)-1-(3-pyridylmethyl)thiourea Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC2=CN=CC=C2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C24H33N3O2S/c1-28-22-12-13-23(29-2)20(15-22)18-27(17-19-9-8-14-25-16-19)24(30)26-21-10-6-4-3-5-7-11-21/h8-9,12-16,21H,3-7,10-11,17-18H2,1-2H3,(H,26,30)