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

Systemtic Name: 4-chloranyl-N-[5-(furan-2-yl)-2-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[5-(2-furyl)-2-(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[5-(2-furanyl)-2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[5-(furan-2-yl)-2-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[5-(2-furyl)-2-(6-isopropyl-4-keto-1H-pyrimidin-2-yl)pyrazol-3-yl]-3-nitro-benzamide Formula: C21H17ClN6O5 MolecularWeight: 468.84988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H17ClN6O5/c1-11(2)14-10-19(29)25-21(23-14)27-18(9-15(26-27)17-4-3-7-33-17)24-20(30)12-5-6-13(22)16(8-12)28(31)32/h3-11H,1-2H3,(H,24,30)(H,23,25,29)