3-(2-ethyl-6-methyl-phenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 3-(2-ethyl-6-methyl-phenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(2-ethyl-6-methyl-phenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(2-ethyl-6-methylphenyl)-1-[(4-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(2-ethyl-6-methylphenyl)-1-[(4-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(2-ethyl-6-methyl-phenyl)-1-(4-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C23H27FN4S MolecularWeight: 410.550683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N(CCCN2C=CN=C2)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C23H27FN4S/c1-3-20-7-4-6-18(2)22(20)26-23(29)28(14-5-13-27-15-12-25-17-27)16-19-8-10-21(24)11-9-19/h4,6-12,15,17H,3,5,13-14,16H2,1-2H3,(H,26,29)