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

Systemtic Name: N-[5-(furan-2-yl)-2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[5-(2-furyl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[5-(2-furanyl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[5-(furan-2-yl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[5-(2-furyl)-2-(4-keto-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide Formula: C21H18N6O5 MolecularWeight: 434.40482

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N6O5/c1-2-5-14-11-19(28)24-21(22-14)26-18(12-16(25-26)17-8-4-9-32-17)23-20(29)13-6-3-7-15(10-13)27(30)31/h3-4,6-12H,2,5H2,1H3,(H,23,29)(H,22,24,28)