1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]pyrimidin-2-yl]amino]phenyl]propan-1-one

Systemtic Name: 1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]pyrimidin-2-yl]amino]phenyl]propan-1-one Openeye Name: 1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]pyrimidin-2-yl]amino]phenyl]propan-1-one CAS Name: 1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]-2-pyrimidinyl]amino]phenyl]-1-propanone IUPAC Name: 1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]pyrimidin-2-yl]amino]phenyl]propan-1-one Traditional Name: 1-[4-methoxy-3-[[4-[(3-methyl-2H-indazol-6-yl)amino]pyrimidin-2-yl]amino]phenyl]propan-1-one Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1)OC)NC2=NC=CC(=N2)NC3=CC4=NNC(=C4C=C3)C

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1)OC)NC2=NC=CC(=N2)NC3=CC4=NNC(=C4C=C3)C

InChI

InChI=1S/C22H22N6O2/c1-4-19(29)14-5-8-20(30-3)18(11-14)25-22-23-10-9-21(26-22)24-15-6-7-16-13(2)27-28-17(16)12-15/h5-12H,4H2,1-3H3,(H,27,28)(H2,23,24,25,26)