5-(1,3-benzodioxol-5-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-[1-(o-tolylmethyl)pyrazol-4-yl]isoxazole-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-3-isoxazolecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-N-[1-(2-methylbenzyl)pyrazol-4-yl]isoxazole-3-carboxamide Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N4O4/c1-14-4-2-3-5-16(14)11-26-12-17(10-23-26)24-22(27)18-9-20(30-25-18)15-6-7-19-21(8-15)29-13-28-19/h2-10,12H,11,13H2,1H3,(H,24,27)