N-(1-adamantylmethyl)-1-[bis(fluoranyl)methyl]-3,5-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-(1-adamantylmethyl)-1-[bis(fluoranyl)methyl]-3,5-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-(1-adamantylmethyl)-1-(difluoromethyl)-3,5-dimethyl-pyrazole-4-sulfonamide CAS Name: N-(1-adamantylmethyl)-1-(difluoromethyl)-3,5-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-(1-adamantylmethyl)-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide Traditional Name: N-(1-adamantylmethyl)-1-(difluoromethyl)-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C17H25F2N3O2S MolecularWeight: 373.461106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(F)F)C)S(=O)(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C(=NN1C(F)F)C)S(=O)(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C17H25F2N3O2S/c1-10-15(11(2)22(21-10)16(18)19)25(23,24)20-9-17-6-12-3-13(7-17)5-14(4-12)8-17/h12-14,16,20H,3-9H2,1-2H3