N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]nicotinamide Formula: C20H14N4O3 MolecularWeight: 358.35016

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CN=C4C(=C3)C(=CN4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CN=C4C(=C3)C(=CN4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C20H14N4O3/c25-20(13-2-1-5-21-8-13)24-16-10-23-19-15(16)6-14(9-22-19)12-3-4-17-18(7-12)27-11-26-17/h1-10H,11H2,(H,22,23)(H,24,25)