1-[2-(4-fluorophenyl)ethyl]-1-[3-(3-methoxy-4-oxidanyl-phenyl)propyl]-3-phenethyl-thiourea

Systemtic Name: 1-[2-(4-fluorophenyl)ethyl]-1-[3-(3-methoxy-4-oxidanyl-phenyl)propyl]-3-phenethyl-thiourea Openeye Name: 1-[2-(4-fluorophenyl)ethyl]-1-[3-(4-hydroxy-3-methoxy-phenyl)propyl]-3-phenethyl-thiourea CAS Name: 1-[2-(4-fluorophenyl)ethyl]-1-[3-(4-hydroxy-3-methoxyphenyl)propyl]-3-phenethylthiourea IUPAC Name: 1-[2-(4-fluorophenyl)ethyl]-1-[3-(4-hydroxy-3-methoxyphenyl)propyl]-3-phenethylthiourea Traditional Name: 1-[2-(4-fluorophenyl)ethyl]-1-[3-(4-hydroxy-3-methoxy-phenyl)propyl]-3-phenethyl-thiourea Formula: C27H31FN2O2S MolecularWeight: 466.610643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCCN(CCC2=CC=C(C=C2)F)C(=S)NCCC3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCCN(CCC2=CC=C(C=C2)F)C(=S)NCCC3=CC=CC=C3)O

InChI

InChI=1S/C27H31FN2O2S/c1-32-26-20-23(11-14-25(26)31)8-5-18-30(19-16-22-9-12-24(28)13-10-22)27(33)29-17-15-21-6-3-2-4-7-21/h2-4,6-7,9-14,20,31H,5,8,15-19H2,1H3,(H,29,33)