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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-thiophen-2-yl-1,3-oxazole Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-(2-thienyl)oxazole CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-thiophen-2-yloxazole IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-2-thiophen-2-yl-1,3-oxazole Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-(2-thienyl)oxazole Formula: C13H12N4O3S MolecularWeight: 304.32438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O3S/c1-8-12(17(18)19)9(2)16(15-8)6-10-7-20-13(14-10)11-4-3-5-21-11/h3-5,7H,6H2,1-2H3