N-[2-(cyanomethyl)indazol-6-yl]-2-[(6-oxidanylidene-1H-pyridin-3-yl)methylamino]benzamide

Systemtic Name: N-[2-(cyanomethyl)indazol-6-yl]-2-[(6-oxidanylidene-1H-pyridin-3-yl)methylamino]benzamide Openeye Name: N-[2-(cyanomethyl)indazol-6-yl]-2-[(6-oxo-1H-pyridin-3-yl)methylamino]benzamide CAS Name: N-[2-(cyanomethyl)-6-indazolyl]-2-[(6-oxo-1H-pyridin-3-yl)methylamino]benzamide IUPAC Name: N-[2-(cyanomethyl)indazol-6-yl]-2-[(6-oxo-1H-pyridin-3-yl)methylamino]benzamide Traditional Name: N-[2-(cyanomethyl)indazol-6-yl]-2-[(6-keto-1H-pyridin-3-yl)methylamino]benzamide Formula: C22H18N6O2 MolecularWeight: 398.41732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=NN(C=C3C=C2)CC#N)NCC4=CNC(=O)C=C4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=NN(C=C3C=C2)CC#N)NCC4=CNC(=O)C=C4

InChI

InChI=1S/C22H18N6O2/c23-9-10-28-14-16-6-7-17(11-20(16)27-28)26-22(30)18-3-1-2-4-19(18)24-12-15-5-8-21(29)25-13-15/h1-8,11,13-14,24H,10,12H2,(H,25,29)(H,26,30)