N-(1,3-benzodioxol-5-ylmethyl)-5-(2-methylphenyl)-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-(2-methylphenyl)-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-(o-tolyl)-2-[[3-(3-pyridyl)-4,5-dihydroisoxazol-5-yl]methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2-methylphenyl)-2-[[3-(3-pyridinyl)-4,5-dihydroisoxazol-5-yl]methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(2-methylphenyl)-2-[(3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl)methyl]pyrazole-3-carboxamide Traditional Name: 5-(o-tolyl)-N-piperonyl-2-[[3-(3-pyridyl)-2-isoxazolin-5-yl]methyl]pyrazole-3-carboxamide Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)CC5CC(=NO5)C6=CN=CC=C6

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)CC5CC(=NO5)C6=CN=CC=C6

InChI

InChI=1S/C28H25N5O4/c1-18-5-2-3-7-22(18)24-13-25(28(34)30-14-19-8-9-26-27(11-19)36-17-35-26)33(31-24)16-21-12-23(32-37-21)20-6-4-10-29-15-20/h2-11,13,15,21H,12,14,16-17H2,1H3,(H,30,34)