N-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-2-[(3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-2-[(3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-2-[[3-(3-pyridyl)-4,5-dihydroisoxazol-5-yl]methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-2-[[3-(3-pyridinyl)-4,5-dihydroisoxazol-5-yl]methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-2-[(3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazole-3-carboxamide Traditional Name: 5-phenyl-N-piperonyl-2-[[3-(3-pyridyl)-2-isoxazolin-5-yl]methyl]pyrazole-3-carboxamide Formula: C27H23N5O4 MolecularWeight: 481.50262

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CN=CC=C2)CN3C(=CC(=N3)C4=CC=CC=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C(ON=C1C2=CN=CC=C2)CN3C(=CC(=N3)C4=CC=CC=C4)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H23N5O4/c33-27(29-14-18-8-9-25-26(11-18)35-17-34-25)24-13-22(19-5-2-1-3-6-19)30-32(24)16-21-12-23(31-36-21)20-7-4-10-28-15-20/h1-11,13,15,21H,12,14,16-17H2,(H,29,33)