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

Systemtic Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-cyclooctyl-1-[(2,5-dimethoxyphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-cyclooctyl-1-(2,5-dimethoxybenzyl)-1-(tetrahydrofurfuryl)thiourea Formula: C23H36N2O3S MolecularWeight: 420.60854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC2CCCO2)C(=S)NC3CCCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC2CCCO2)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C23H36N2O3S/c1-26-20-12-13-22(27-2)18(15-20)16-25(17-21-11-8-14-28-21)23(29)24-19-9-6-4-3-5-7-10-19/h12-13,15,19,21H,3-11,14,16-17H2,1-2H3,(H,24,29)