1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-phenylphenyl)thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-phenylphenyl)thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-phenylphenyl)thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-(4-phenylphenyl)thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-phenylphenyl)thiourea Traditional Name: 1-(4-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)-3-(4-phenylphenyl)thiourea Formula: C26H25FN4S MolecularWeight: 444.566903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=S)N(CCCN3C=CN=C3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=S)N(CCCN3C=CN=C3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C26H25FN4S/c27-24-11-7-21(8-12-24)19-31(17-4-16-30-18-15-28-20-30)26(32)29-25-13-9-23(10-14-25)22-5-2-1-3-6-22/h1-3,5-15,18,20H,4,16-17,19H2,(H,29,32)