1-(1-adamantyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-(1-adamantyl)-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-(1-adamantyl)-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-(1-adamantyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-(1-adamantyl)-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C18H21F3N2OS MolecularWeight: 370.43235

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C18H21F3N2OS/c19-18(20,21)24-15-3-1-14(2-4-15)22-16(25)23-17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2,(H2,22,23,25)