5-tert-butyl-N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-tert-butyl-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-tert-butyl-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]pyrazole-3-carboxamide Traditional Name: 2-benzyl-5-tert-butyl-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]pyrazole-3-carboxamide Formula: C24H26FN3O3 MolecularWeight: 423.479943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NCC2=C3C(=CC(=C2)F)COCO3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NCC2=C3C(=CC(=C2)F)COCO3)CC4=CC=CC=C4

InChI

InChI=1S/C24H26FN3O3/c1-24(2,3)21-11-20(28(27-21)13-16-7-5-4-6-8-16)23(29)26-12-17-9-19(25)10-18-14-30-15-31-22(17)18/h4-11H,12-15H2,1-3H3,(H,26,29)