4-[4-[[5-chloranyl-4-(1H-indazol-3-ylamino)pyrimidin-2-yl]amino]-5-fluoranyl-2-methyl-phenyl]-N-methyl-benzamide

Systemtic Name: 4-[4-[[5-chloranyl-4-(1H-indazol-3-ylamino)pyrimidin-2-yl]amino]-5-fluoranyl-2-methyl-phenyl]-N-methyl-benzamide Openeye Name: 4-[4-[[5-chloro-4-(1H-indazol-3-ylamino)pyrimidin-2-yl]amino]-5-fluoro-2-methyl-phenyl]-N-methyl-benzamide CAS Name: 4-[4-[[5-chloro-4-(1H-indazol-3-ylamino)-2-pyrimidinyl]amino]-5-fluoro-2-methylphenyl]-N-methylbenzamide IUPAC Name: 4-[4-[[5-chloro-4-(1H-indazol-3-ylamino)pyrimidin-2-yl]amino]-5-fluoro-2-methylphenyl]-N-methylbenzamide Traditional Name: 4-[4-[[5-chloro-4-(1H-indazol-3-ylamino)pyrimidin-2-yl]amino]-5-fluoro-2-methyl-phenyl]-N-methyl-benzamide Formula: C26H21ClFN7O MolecularWeight: 501.942643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC=C(C=C2)C(=O)NC)F)NC3=NC=C(C(=N3)NC4=NNC5=CC=CC=C54)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC=C(C=C2)C(=O)NC)F)NC3=NC=C(C(=N3)NC4=NNC5=CC=CC=C54)Cl

InChI

InChI=1S/C26H21ClFN7O/c1-14-11-22(20(28)12-18(14)15-7-9-16(10-8-15)25(36)29-2)31-26-30-13-19(27)24(33-26)32-23-17-5-3-4-6-21(17)34-35-23/h3-13H,1-2H3,(H,29,36)(H3,30,31,32,33,34,35)