N-[(4-methoxyphenyl)-pyridin-4-yl-methyl]-3-[2-(3-methylimidazol-4-yl)ethynyl]-2H-indazole-6-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)-pyridin-4-yl-methyl]-3-[2-(3-methylimidazol-4-yl)ethynyl]-2H-indazole-6-carboxamide Openeye Name: N-[(4-methoxyphenyl)-(4-pyridyl)methyl]-3-[2-(3-methylimidazol-4-yl)ethynyl]-2H-indazole-6-carboxamide CAS Name: N-[(4-methoxyphenyl)-pyridin-4-ylmethyl]-3-[2-(3-methyl-4-imidazolyl)ethynyl]-2H-indazole-6-carboxamide IUPAC Name: N-[(4-methoxyphenyl)-pyridin-4-ylmethyl]-3-[2-(3-methylimidazol-4-yl)ethynyl]-2H-indazole-6-carboxamide Traditional Name: N-[(4-methoxyphenyl)-(4-pyridyl)methyl]-3-[2-(3-methylimidazol-4-yl)ethynyl]-2H-indazole-6-carboxamide Formula: C27H22N6O2 MolecularWeight: 462.50258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C#CC2=C3C=CC(=CC3=NN2)C(=O)NC(C4=CC=C(C=C4)OC)C5=CC=NC=C5

Isomeric SMILES

CN1C=NC=C1C#CC2=C3C=CC(=CC3=NN2)C(=O)NC(C4=CC=C(C=C4)OC)C5=CC=NC=C5

InChI

InChI=1S/C27H22N6O2/c1-33-17-29-16-21(33)6-10-24-23-9-5-20(15-25(23)32-31-24)27(34)30-26(19-11-13-28-14-12-19)18-3-7-22(35-2)8-4-18/h3-5,7-9,11-17,26H,1-2H3,(H,30,34)(H,31,32)