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

Systemtic Name: 6-[[2-[(5-chloranyl-4-methoxy-2-methyl-phenyl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[2-(5-chloro-4-methoxy-2-methyl-anilino)-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one CAS Name: 6-[[2-(5-chloro-4-methoxy-2-methylanilino)-5-fluoro-4-pyrimidinyl]amino]-2-methyl-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[2-(5-chloro-4-methoxy-2-methylanilino)-5-fluoropyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[2-(5-chloro-4-methoxy-2-methyl-anilino)-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzoxazin-3-one Formula: C21H19ClFN5O3 MolecularWeight: 443.858663

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=C(C=C4C)OC)Cl

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=C(C=C4C)OC)Cl

InChI

InChI=1S/C21H19ClFN5O3/c1-10-6-18(30-3)13(22)8-15(10)27-21-24-9-14(23)19(28-21)25-12-4-5-17-16(7-12)26-20(29)11(2)31-17/h4-9,11H,1-3H3,(H,26,29)(H2,24,25,27,28)