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

Systemtic Name: N-[5-tert-butyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[5-tert-butyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[5-tert-butyl-2-(4-keto-6-methyl-1H-pyrimidin-2-yl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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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)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H23N5O4/c1-12-9-18(27)24-20(22-12)26-17(10-16(25-26)21(2,3)4)23-19(28)15-11-29-13-7-5-6-8-14(13)30-15/h5-10,15H,11H2,1-4H3,(H,23,28)(H,22,24,27)