3-(1-adamantyl)-N-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[4-(difluoromethoxy)-3-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[4-(difluoromethoxy)-3-methoxyphenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[4-(difluoromethoxy)-3-methoxyphenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[4-(difluoromethoxy)-3-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C28H29F2N3O3 MolecularWeight: 493.544966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)OC(F)F

InChI

InChI=1S/C28H29F2N3O3/c1-35-24-12-20(7-8-23(24)36-27(29)30)31-26(34)22-16-33(21-5-3-2-4-6-21)32-25(22)28-13-17-9-18(14-28)11-19(10-17)15-28/h2-8,12,16-19,27H,9-11,13-15H2,1H3,(H,31,34)