1-[(3-cyanophenyl)methyl]-4,5-dimethoxy-N-(pyridin-4-ylmethyl)indole-2-carboxamide

Systemtic Name: 1-[(3-cyanophenyl)methyl]-4,5-dimethoxy-N-(pyridin-4-ylmethyl)indole-2-carboxamide Openeye Name: 1-[(3-cyanophenyl)methyl]-4,5-dimethoxy-N-(4-pyridylmethyl)indole-2-carboxamide CAS Name: 1-[(3-cyanophenyl)methyl]-4,5-dimethoxy-N-(pyridin-4-ylmethyl)-2-indolecarboxamide IUPAC Name: 1-[(3-cyanophenyl)methyl]-4,5-dimethoxy-N-(pyridin-4-ylmethyl)indole-2-carboxamide Traditional Name: 1-(3-cyanobenzyl)-4,5-dimethoxy-N-(4-pyridylmethyl)indole-2-carboxamide Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N(C(=C2)C(=O)NCC3=CC=NC=C3)CC4=CC=CC(=C4)C#N)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)N(C(=C2)C(=O)NCC3=CC=NC=C3)CC4=CC=CC(=C4)C#N)OC

InChI

InChI=1S/C25H22N4O3/c1-31-23-7-6-21-20(24(23)32-2)13-22(25(30)28-15-17-8-10-27-11-9-17)29(21)16-19-5-3-4-18(12-19)14-26/h3-13H,15-16H2,1-2H3,(H,28,30)