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

Systemtic Name: N-[5-(furan-2-yl)-2-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-iodanyl-benzamide Openeye Name: N-[5-(2-furyl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-iodo-benzamide CAS Name: N-[5-(2-furanyl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-iodobenzamide IUPAC Name: N-[5-(furan-2-yl)-2-(4-oxo-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-iodobenzamide Traditional Name: N-[5-(2-furyl)-2-(4-keto-6-propyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-iodo-benzamide Formula: C21H18IN5O3 MolecularWeight: 515.30379

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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=C4I

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C4=CC=CC=C4I

InChI

InChI=1S/C21H18IN5O3/c1-2-6-13-11-19(28)25-21(23-13)27-18(12-16(26-27)17-9-5-10-30-17)24-20(29)14-7-3-4-8-15(14)22/h3-5,7-12H,2,6H2,1H3,(H,24,29)(H,23,25,28)