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

Systemtic Name: 6-[[2-[(1-ethyl-2-methyl-benzimidazol-5-yl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[2-[(1-ethyl-2-methyl-benzimidazol-5-yl)amino]-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one CAS Name: 6-[[2-[(1-ethyl-2-methyl-5-benzimidazolyl)amino]-5-fluoro-4-pyrimidinyl]amino]-2-methyl-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[2-[(1-ethyl-2-methylbenzimidazol-5-yl)amino]-5-fluoropyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[2-[(1-ethyl-2-methyl-benzimidazol-5-yl)amino]-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Formula: C23H22FN7O2 MolecularWeight: 447.464883

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC5=C(C=C4)OC(C(=O)N5)C)F)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)NC3=NC=C(C(=N3)NC4=CC5=C(C=C4)OC(C(=O)N5)C)F)C

InChI

InChI=1S/C23H22FN7O2/c1-4-31-13(3)26-17-9-15(5-7-19(17)31)28-23-25-11-16(24)21(30-23)27-14-6-8-20-18(10-14)29-22(32)12(2)33-20/h5-12H,4H2,1-3H3,(H,29,32)(H2,25,27,28,30)