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

Systemtic Name: 1-(2-adamantylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-adamantylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-adamantylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-adamantylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-adamantylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C18H20F3N3S MolecularWeight: 367.43171

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20F3N3S/c19-18(20,21)14-3-1-2-4-15(14)22-17(25)24-23-16-12-6-10-5-11(8-12)9-13(16)7-10/h1-4,10-13H,5-9H2,(H2,22,24,25)