3-cyclooctyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5-methylfuran-2-yl)methyl]thiourea

Systemtic Name: 3-cyclooctyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5-methylfuran-2-yl)methyl]thiourea Openeye Name: 3-cyclooctyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5-methyl-2-furyl)methyl]thiourea CAS Name: 3-cyclooctyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5-methyl-2-furanyl)methyl]thiourea IUPAC Name: 3-cyclooctyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5-methylfuran-2-yl)methyl]thiourea Traditional Name: 3-cyclooctyl-1-homoveratryl-1-[(5-methyl-2-furyl)methyl]thiourea Formula: C25H36N2O3S MolecularWeight: 444.62994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=S)NC3CCCCCCC3

Isomeric SMILES

CC1=CC=C(O1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=S)NC3CCCCCCC3

InChI

InChI=1S/C25H36N2O3S/c1-19-11-13-22(30-19)18-27(25(31)26-21-9-7-5-4-6-8-10-21)16-15-20-12-14-23(28-2)24(17-20)29-3/h11-14,17,21H,4-10,15-16,18H2,1-3H3,(H,26,31)