N-[5-tert-butyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-benzamide

Systemtic Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-chloranyl-4-fluoranyl-benzamide Openeye Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-chloro-4-fluoro-benzamide CAS Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-chloro-4-fluorobenzamide IUPAC Name: N-[5-tert-butyl-2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-chloro-4-fluorobenzamide Traditional Name: N-[5-tert-butyl-2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-chloro-4-fluoro-benzamide Formula: C20H21ClFN5O2 MolecularWeight: 417.864443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=C(C=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=C(C=C(C=C3)F)Cl)C

InChI

InChI=1S/C20H21ClFN5O2/c1-10-11(2)23-19(25-17(10)28)27-16(9-15(26-27)20(3,4)5)24-18(29)13-7-6-12(22)8-14(13)21/h6-9H,1-5H3,(H,24,29)(H,23,25,28)