5-(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)-3-(thiophen-3-ylsulfonylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)-3-(thiophen-3-ylsulfonylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(4-bromo-2-ethyl-5-methyl-pyrazol-3-yl)-3-(3-thienylsulfonylmethyl)-1,2,4-oxadiazole CAS Name: 5-(4-bromo-2-ethyl-5-methyl-3-pyrazolyl)-3-(3-thiophenylsulfonylmethyl)-1,2,4-oxadiazole IUPAC Name: 5-(4-bromo-2-ethyl-5-methylpyrazol-3-yl)-3-(thiophen-3-ylsulfonylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(4-bromo-2-ethyl-5-methyl-pyrazol-3-yl)-3-(3-thienylsulfonylmethyl)-1,2,4-oxadiazole Formula: C13H13BrN4O3S2 MolecularWeight: 417.30132

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)Br)C2=NC(=NO2)CS(=O)(=O)C3=CSC=C3

Isomeric SMILES

CCN1C(=C(C(=N1)C)Br)C2=NC(=NO2)CS(=O)(=O)C3=CSC=C3

InChI

InChI=1S/C13H13BrN4O3S2/c1-3-18-12(11(14)8(2)16-18)13-15-10(17-21-13)7-23(19,20)9-4-5-22-6-9/h4-6H,3,7H2,1-2H3