3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-1-(3,3-dimethyl-1,2-dihydroindol-6-yl)-4-methyl-pyridin-2-one

Systemtic Name: 3-[2-(2-azanylpyrimidin-5-yl)ethynyl]-1-(3,3-dimethyl-1,2-dihydroindol-6-yl)-4-methyl-pyridin-2-one Openeye Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-1-(3,3-dimethylindolin-6-yl)-4-methyl-pyridin-2-one CAS Name: 3-[2-(2-amino-5-pyrimidinyl)ethynyl]-1-(3,3-dimethyl-1,2-dihydroindol-6-yl)-4-methyl-2-pyridinone IUPAC Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-1-(3,3-dimethyl-1,2-dihydroindol-6-yl)-4-methylpyridin-2-one Traditional Name: 3-[2-(2-aminopyrimidin-5-yl)ethynyl]-1-(3,3-dimethylindolin-6-yl)-4-methyl-2-pyridone Formula: C22H21N5O MolecularWeight: 371.43504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C=C1)C2=CC3=C(C=C2)C(CN3)(C)C)C#CC4=CN=C(N=C4)N

Isomeric SMILES

CC1=C(C(=O)N(C=C1)C2=CC3=C(C=C2)C(CN3)(C)C)C#CC4=CN=C(N=C4)N

InChI

InChI=1S/C22H21N5O/c1-14-8-9-27(16-5-7-18-19(10-16)26-13-22(18,2)3)20(28)17(14)6-4-15-11-24-21(23)25-12-15/h5,7-12,26H,13H2,1-3H3,(H2,23,24,25)