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

Systemtic Name: 4-[[5-fluoranyl-4-[[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]amino]pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[5-fluoro-4-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[5-fluoro-4-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[5-fluoro-4-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[5-fluoro-4-[[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]amino]pyrimidin-2-yl]amino]benzamide Formula: C20H17FN6O3 MolecularWeight: 408.385783

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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=C4)C(=O)N

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C20H17FN6O3/c1-10-19(29)26-15-8-13(6-7-16(15)30-10)24-18-14(21)9-23-20(27-18)25-12-4-2-11(3-5-12)17(22)28/h2-10H,1H3,(H2,22,28)(H,26,29)(H2,23,24,25,27)/t10-/m0/s1