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

Systemtic Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Openeye Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(3-thienyl)-1,2,4-oxadiazole CAS Name: 5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-(3-thiophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-3-thiophen-3-yl-1,2,4-oxadiazole Traditional Name: 5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-3-(3-thienyl)-1,2,4-oxadiazole Formula: C12H11N5O3S MolecularWeight: 305.31244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC(=NO2)C3=CSC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NC(=NO2)C3=CSC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O3S/c1-7-11(17(18)19)8(2)16(14-7)5-10-13-12(15-20-10)9-3-4-21-6-9/h3-4,6H,5H2,1-2H3