N-(1-adamantylmethyl)-1-[bis(fluoranyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-1-[bis(fluoranyl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-1-(difluoromethyl)pyrazole-3-carboxamide CAS Name: N-(1-adamantylmethyl)-1-(difluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-1-(difluoromethyl)pyrazole-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-1-(difluoromethyl)pyrazole-3-carboxamide Formula: C16H21F2N3O MolecularWeight: 309.354246

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NN(C=C4)C(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NN(C=C4)C(F)F

InChI

InChI=1S/C16H21F2N3O/c17-15(18)21-2-1-13(20-21)14(22)19-9-16-6-10-3-11(7-16)5-12(4-10)8-16/h1-2,10-12,15H,3-9H2,(H,19,22)