6-[[2-[(3,5-dimethoxyphenyl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[[2-[(3,5-dimethoxyphenyl)amino]-5-fluoranyl-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[[2-(3,5-dimethoxyanilino)-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzothiazin-3-one CAS Name: 6-[[2-(3,5-dimethoxyanilino)-5-fluoro-4-pyrimidinyl]amino]-2-methyl-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[[2-(3,5-dimethoxyanilino)-5-fluoropyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzothiazin-3-one Traditional Name: 6-[[2-(3,5-dimethoxyanilino)-5-fluoro-pyrimidin-4-yl]amino]-2-methyl-4H-1,4-benzothiazin-3-one Formula: C21H20FN5O3S MolecularWeight: 441.478603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC1C(=O)NC2=C(S1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C21H20FN5O3S/c1-11-20(28)26-17-8-12(4-5-18(17)31-11)24-19-16(22)10-23-21(27-19)25-13-6-14(29-2)9-15(7-13)30-3/h4-11H,1-3H3,(H,26,28)(H2,23,24,25,27)