4-[3,3-dimethyl-2-oxidanylidene-4-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]pyrrolidin-1-yl]adamantane-1-carboximidamide

Systemtic Name: 4-[3,3-dimethyl-2-oxidanylidene-4-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]pyrrolidin-1-yl]adamantane-1-carboximidamide Openeye Name: 4-[3,3-dimethyl-2-oxo-4-[[5-(trifluoromethyl)-2-pyridyl]oxymethyl]pyrrolidin-1-yl]adamantane-1-carboxamidine CAS Name: 4-[3,3-dimethyl-2-oxo-4-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]-1-pyrrolidinyl]-1-adamantanecarboximidamide IUPAC Name: 4-[3,3-dimethyl-2-oxo-4-[[5-(trifluoromethyl)pyridin-2-yl]oxymethyl]pyrrolidin-1-yl]adamantane-1-carboximidamide Traditional Name: 4-[2-keto-3,3-dimethyl-4-[[5-(trifluoromethyl)-2-pyridyl]oxymethyl]pyrrolidino]adamantane-1-carboxamidine Formula: C24H31F3N4O2 MolecularWeight: 464.52375

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CN(C1=O)C2C3CC4CC2CC(C4)(C3)C(=N)N)COC5=NC=C(C=C5)C(F)(F)F)C

Isomeric SMILES

CC1(C(CN(C1=O)C2C3CC4CC2CC(C4)(C3)C(=N)N)COC5=NC=C(C=C5)C(F)(F)F)C

InChI

InChI=1S/C24H31F3N4O2/c1-22(2)17(12-33-18-4-3-16(10-30-18)24(25,26)27)11-31(21(22)32)19-14-5-13-6-15(19)9-23(7-13,8-14)20(28)29/h3-4,10,13-15,17,19H,5-9,11-12H2,1-2H3,(H3,28,29)