3-(1,3-benzodioxol-5-yl)-5-[(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-3,5-dimethyl-1-pyrazolyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-3,5-dimethylpyrazol-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,4-oxadiazole Formula: C15H13IN4O3 MolecularWeight: 424.19319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)C)I

Isomeric SMILES

CC1=C(C(=NN1CC2=NC(=NO2)C3=CC4=C(C=C3)OCO4)C)I

InChI

InChI=1S/C15H13IN4O3/c1-8-14(16)9(2)20(18-8)6-13-17-15(19-23-13)10-3-4-11-12(5-10)22-7-21-11/h3-5H,6-7H2,1-2H3