N-[5-tert-butyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]quinoxaline-2-carboxamide Openeye Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]quinoxaline-2-carboxamide CAS Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2-quinoxalinecarboxamide IUPAC Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]quinoxaline-2-carboxamide Traditional Name: N-[5-tert-butyl-2-(4-keto-6-methyl-1H-pyrimidin-2-yl)pyrazol-3-yl]quinoxaline-2-carboxamide Formula: C21H21N7O2 MolecularWeight: 403.43714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H21N7O2/c1-12-9-18(29)26-20(23-12)28-17(10-16(27-28)21(2,3)4)25-19(30)15-11-22-13-7-5-6-8-14(13)24-15/h5-11H,1-4H3,(H,25,30)(H,23,26,29)