3-tert-butyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 3-tert-butyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-tert-butyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-tert-butyl-1-[(3-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-tert-butyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-tert-butyl-1-(3-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C18H25FN4S MolecularWeight: 348.481303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)N(CCCN1C=CN=C1)CC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)NC(=S)N(CCCN1C=CN=C1)CC2=CC(=CC=C2)F

InChI

InChI=1S/C18H25FN4S/c1-18(2,3)21-17(24)23(10-5-9-22-11-8-20-14-22)13-15-6-4-7-16(19)12-15/h4,6-8,11-12,14H,5,9-10,13H2,1-3H3,(H,21,24)