N-[4-tert-butyl-3-[(E)-4-pyrrolidin-3-ylbut-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)pyridine-3-carboxamide

Systemtic Name: N-[4-tert-butyl-3-[(E)-4-pyrrolidin-3-ylbut-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)pyridine-3-carboxamide Openeye Name: N-[4-tert-butyl-3-[(E)-4-pyrrolidin-3-ylbut-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)pyridine-3-carboxamide CAS Name: N-[4-tert-butyl-3-[(E)-4-(3-pyrrolidinyl)but-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)-3-pyridinecarboxamide IUPAC Name: N-[4-tert-butyl-3-[(E)-4-pyrrolidin-3-ylbut-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)pyridine-3-carboxamide Traditional Name: N-[4-tert-butyl-3-[(E)-4-pyrrolidin-3-ylbut-1-enyl]phenyl]-2-(1H-indazol-6-ylamino)nicotinamide Formula: C31H36N6O MolecularWeight: 508.65714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)NC3=CC4=C(C=C3)C=NN4)C=CCCC5CCNC5

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)NC3=CC4=C(C=C3)C=NN4)/C=C/CCC5CCNC5

InChI

InChI=1S/C31H36N6O/c1-31(2,3)27-13-12-24(17-22(27)8-5-4-7-21-14-16-32-19-21)36-30(38)26-9-6-15-33-29(26)35-25-11-10-23-20-34-37-28(23)18-25/h5-6,8-13,15,17-18,20-21,32H,4,7,14,16,19H2,1-3H3,(H,33,35)(H,34,37)(H,36,38)/b8-5+