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

Systemtic Name: 3-cycloheptyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-cycloheptyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-cycloheptyl-1-[(3-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-cycloheptyl-1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-cycloheptyl-1-(3-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C21H29FN4S MolecularWeight: 388.545163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

C1CCCC(CC1)NC(=S)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H29FN4S/c22-19-8-5-7-18(15-19)16-26(13-6-12-25-14-11-23-17-25)21(27)24-20-9-3-1-2-4-10-20/h5,7-8,11,14-15,17,20H,1-4,6,9-10,12-13,16H2,(H,24,27)