1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[1-(1-adamantyl)ethyl]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C20H25F3N2S MolecularWeight: 382.48611

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C20H25F3N2S/c1-12(19-9-13-6-14(10-19)8-15(7-13)11-19)24-18(26)25-17-5-3-2-4-16(17)20(21,22)23/h2-5,12-15H,6-11H2,1H3,(H2,24,25,26)