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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CC2=CC=CC=N2)C(=S)NC3CCCCCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CC2=CC=CC=N2)C(=S)NC3CCCCCCC3

InChI

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