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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NOC(=N2)C3=CC=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NOC(=N2)C3=CC=CS3)C)[N+](=O)[O-]

InChI

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