1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-isopropylphenyl)thiourea CAS Name: 1-[(3-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(3-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)-3-p-cumenyl-thiourea Formula: C23H27FN4S MolecularWeight: 410.550683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H27FN4S/c1-18(2)20-7-9-22(10-8-20)26-23(29)28(13-4-12-27-14-11-25-17-27)16-19-5-3-6-21(24)15-19/h3,5-11,14-15,17-18H,4,12-13,16H2,1-2H3,(H,26,29)