N-(1-ethanoyl-3,3-dimethyl-2H-indol-6-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide

Systemtic Name: N-(1-ethanoyl-3,3-dimethyl-2H-indol-6-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Openeye Name: N-(1-acetyl-3,3-dimethyl-indolin-6-yl)-2-(7-isoquinolylamino)pyridine-3-carboxamide CAS Name: N-(1-acetyl-3,3-dimethyl-2H-indol-6-yl)-2-(7-isoquinolinylamino)-3-pyridinecarboxamide IUPAC Name: N-(1-acetyl-3,3-dimethyl-2H-indol-6-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Traditional Name: N-(1-acetyl-3,3-dimethyl-indolin-6-yl)-2-(7-isoquinolylamino)nicotinamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C2=C1C=C(C=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)(C)C

Isomeric SMILES

CC(=O)N1CC(C2=C1C=C(C=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)(C)C

InChI

InChI=1S/C27H25N5O2/c1-17(33)32-16-27(2,3)23-9-8-21(14-24(23)32)31-26(34)22-5-4-11-29-25(22)30-20-7-6-18-10-12-28-15-19(18)13-20/h4-15H,16H2,1-3H3,(H,29,30)(H,31,34)