N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(3,3-dimethylindolin-6-yl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(4-pyrimidinylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(3,3-dimethyl-1,2-dihydroindol-6-yl)-2-(pyrimidin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(3,3-dimethylindolin-6-yl)-2-(4-pyrimidylmethylamino)nicotinamide Formula: C21H22N6O MolecularWeight: 374.43898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=NC=NC=C4)C

Isomeric SMILES

CC1(CNC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=NC=NC=C4)C

InChI

InChI=1S/C21H22N6O/c1-21(2)12-25-18-10-14(5-6-17(18)21)27-20(28)16-4-3-8-23-19(16)24-11-15-7-9-22-13-26-15/h3-10,13,25H,11-12H2,1-2H3,(H,23,24)(H,27,28)