1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(1-adamantylmethyl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C19H23F3N2S MolecularWeight: 368.45953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23F3N2S/c20-19(21,22)15-2-1-3-16(7-15)24-17(25)23-11-18-8-12-4-13(9-18)6-14(5-12)10-18/h1-3,7,12-14H,4-6,8-11H2,(H2,23,24,25)