N-[2-(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[2-(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furanyl)-3-pyrazolyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[2-(6-ethyl-4-keto-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C22H20N6O7 MolecularWeight: 480.4302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=C(C=C4[N+](=O)[O-])OC)OC

Isomeric SMILES

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=C(C=C4[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H20N6O7/c1-4-12-8-20(29)25-22(23-12)27-19(10-14(26-27)16-6-5-7-35-16)24-21(30)13-9-17(33-2)18(34-3)11-15(13)28(31)32/h5-11H,4H2,1-3H3,(H,24,30)(H,23,25,29)