N-(1,3-benzodioxol-5-ylmethyl)-3-[1-(4-bromophenyl)-3-methyl-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[1-(4-bromophenyl)-3-methyl-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[1-(4-bromophenyl)-3-methyl-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[1-(4-bromophenyl)-3-methyl-4-pyrazolyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[1-(4-bromophenyl)-3-methylpyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-[1-(4-bromophenyl)-3-methyl-pyrazol-4-yl]-N-piperonyl-1,2,4-oxadiazole-5-carboxamide Formula: C21H16BrN5O4 MolecularWeight: 482.28684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NOC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=NN(C=C1C2=NOC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C21H16BrN5O4/c1-12-16(10-27(25-12)15-5-3-14(22)4-6-15)19-24-21(31-26-19)20(28)23-9-13-2-7-17-18(8-13)30-11-29-17/h2-8,10H,9,11H2,1H3,(H,23,28)