tert-butyl N-[[6-(3,5-dimethyl-4-nitro-pyrazol-1-yl)pyridazin-3-yl]amino]carbamate

Systemtic Name: tert-butyl N-[[6-(3,5-dimethyl-4-nitro-pyrazol-1-yl)pyridazin-3-yl]amino]carbamate Openeye Name: tert-butyl N-[[6-(3,5-dimethyl-4-nitro-pyrazol-1-yl)pyridazin-3-yl]amino]carbamate CAS Name: N-[[6-(3,5-dimethyl-4-nitro-1-pyrazolyl)-3-pyridazinyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[6-(3,5-dimethyl-4-nitropyrazol-1-yl)pyridazin-3-yl]amino]carbamate Traditional Name: N-[[6-(3,5-dimethyl-4-nitro-pyrazol-1-yl)pyridazin-3-yl]amino]carbamic acid tert-butyl ester Formula: C14H19N7O4 MolecularWeight: 349.34516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NN=C(C=C2)NNC(=O)OC(C)(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=NN=C(C=C2)NNC(=O)OC(C)(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N7O4/c1-8-12(21(23)24)9(2)20(19-8)11-7-6-10(15-17-11)16-18-13(22)25-14(3,4)5/h6-7H,1-5H3,(H,15,16)(H,18,22)