3-cyclooctyl-1-[(3-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-cyclooctyl-1-[(3-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 3-cyclooctyl-1-[(3-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 3-cyclooctyl-1-[(3-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 3-cyclooctyl-1-[(3-fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 3-cyclooctyl-1-(3-fluorobenzyl)-1-p-anisyl-thiourea Formula: C24H31FN2OS MolecularWeight: 414.579143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31FN2OS/c1-28-23-14-12-19(13-15-23)17-27(18-20-8-7-9-21(25)16-20)24(29)26-22-10-5-3-2-4-6-11-22/h7-9,12-16,22H,2-6,10-11,17-18H2,1H3,(H,26,29)