5-[2-(3-azanyl-1H-indazol-4-yl)ethynyl]-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-[2-(3-azanyl-1H-indazol-4-yl)ethynyl]-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2-propan-2-yloxy-benzamide Openeye Name: 5-[2-(3-amino-1H-indazol-4-yl)ethynyl]-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-2-isopropoxy-benzamide CAS Name: 5-[2-(3-amino-1H-indazol-4-yl)ethynyl]-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide IUPAC Name: 5-[2-(3-amino-1H-indazol-4-yl)ethynyl]-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide Traditional Name: 5-[2-(3-amino-1H-indazol-4-yl)ethynyl]-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]-2-isopropoxy-benzamide Formula: C30H29N5O3 MolecularWeight: 507.58296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C#CC2=C3C(=CC=C2)NN=C3N)C(=O)NC(CC4=CNC5=CC=CC=C54)CO

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C#CC2=C3C(=CC=C2)NN=C3N)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO

InChI

InChI=1S/C30H29N5O3/c1-18(2)38-27-13-11-19(10-12-20-6-5-9-26-28(20)29(31)35-34-26)14-24(27)30(37)33-22(17-36)15-21-16-32-25-8-4-3-7-23(21)25/h3-9,11,13-14,16,18,22,32,36H,15,17H2,1-2H3,(H,33,37)(H3,31,34,35)/t22-/m1/s1