5-fluoranyl-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-fluoranyl-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-fluoro-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine CAS Name: 5-fluoro-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine IUPAC Name: 5-fluoro-4-N-(1H-indazol-4-yl)-4-N-methyl-2-N-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-fluoro-2-(3-mesylanilino)pyrimidin-4-yl]-(1H-indazol-4-yl)-methyl-amine Formula: C19H17FN6O2S MolecularWeight: 412.440683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C19H17FN6O2S/c1-26(17-8-4-7-16-14(17)10-22-25-16)18-15(20)11-21-19(24-18)23-12-5-3-6-13(9-12)29(2,27)28/h3-11H,1-2H3,(H,22,25)(H,21,23,24)