1-(1-adamantylcarbonylamino)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(1-adamantylcarbonylamino)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(adamantane-1-carbonylamino)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[1-adamantyl(oxo)methyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(adamantane-1-carbonylamino)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(adamantane-1-carbonylamino)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C19H22F3N3OS MolecularWeight: 397.45769

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C19H22F3N3OS/c20-19(21,22)14-3-1-2-4-15(14)23-17(27)25-24-16(26)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2,(H,24,26)(H2,23,25,27)