2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfonyl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfonyl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfonyl]-N-(2-furylmethyl)acetamide CAS Name: 2-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methylsulfonyl]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methylsulfonyl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methylsulfonyl]-N-(2-furfuryl)acetamide Formula: C13H16N4O6S MolecularWeight: 356.35434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CS(=O)(=O)CC(=O)NCC2=CC=CO2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CS(=O)(=O)CC(=O)NCC2=CC=CO2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O6S/c1-9-13(17(19)20)10(2)16(15-9)8-24(21,22)7-12(18)14-6-11-4-3-5-23-11/h3-5H,6-8H2,1-2H3,(H,14,18)