N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide

Systemtic Name: N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Openeye Name: N-(5-tert-butylisoxazol-3-yl)-2-(7-isoquinolylamino)pyridine-3-carboxamide CAS Name: N-(5-tert-butyl-3-isoxazolyl)-2-(7-isoquinolinylamino)-3-pyridinecarboxamide IUPAC Name: N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Traditional Name: N-(5-tert-butylisoxazol-3-yl)-2-(7-isoquinolylamino)nicotinamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=O)C2=C(N=CC=C2)NC3=CC4=C(C=C3)C=CN=C4

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=O)C2=C(N=CC=C2)NC3=CC4=C(C=C3)C=CN=C4

InChI

InChI=1S/C22H21N5O2/c1-22(2,3)18-12-19(27-29-18)26-21(28)17-5-4-9-24-20(17)25-16-7-6-14-8-10-23-13-15(14)11-16/h4-13H,1-3H3,(H,24,25)(H,26,27,28)