1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(1-cyclohex-3-enylmethyl)-1-[3-(1-imidazolyl)propyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C21H25F3N4S MolecularWeight: 422.51021

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CC(CC=C1)CN(CCCN2C=CN=C2)C(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H25F3N4S/c22-21(23,24)18-9-4-5-10-19(18)26-20(29)28(15-17-7-2-1-3-8-17)13-6-12-27-14-11-25-16-27/h1-2,4-5,9-11,14,16-17H,3,6-8,12-13,15H2,(H,26,29)