6-[[5-fluoranyl-2-[(1-methyl-2-oxidanylidene-3H-benzimidazol-5-yl)amino]pyrimidin-4-yl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[5-fluoranyl-2-[(1-methyl-2-oxidanylidene-3H-benzimidazol-5-yl)amino]pyrimidin-4-yl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[5-fluoro-2-[(1-methyl-2-oxo-3H-benzimidazol-5-yl)amino]pyrimidin-4-yl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one CAS Name: 6-[[5-fluoro-2-[(1-methyl-2-oxo-3H-benzimidazol-5-yl)amino]-4-pyrimidinyl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[5-fluoro-2-[(1-methyl-2-oxo-3H-benzimidazol-5-yl)amino]pyrimidin-4-yl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[5-fluoro-2-[(2-keto-1-methyl-3H-benzimidazol-5-yl)amino]pyrimidin-4-yl]amino]-2,2-dimethyl-4H-1,4-benzoxazin-3-one Formula: C22H20FN7O3 MolecularWeight: 449.437703

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)N(C(=O)N5)C)C

Isomeric SMILES

CC1(C(=O)NC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC5=C(C=C4)N(C(=O)N5)C)C

InChI

InChI=1S/C22H20FN7O3/c1-22(2)19(31)27-15-9-11(5-7-17(15)33-22)25-18-13(23)10-24-20(29-18)26-12-4-6-16-14(8-12)28-21(32)30(16)3/h4-10H,1-3H3,(H,27,31)(H,28,32)(H2,24,25,26,29)