N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Openeye Name: N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide CAS Name: N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide IUPAC Name: N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide Traditional Name: N-[5-[4-(dimethylaminomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]nicotinamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H21N5O/c1-27(2)14-15-5-7-16(8-6-15)18-10-19-20(13-25-21(19)24-12-18)26-22(28)17-4-3-9-23-11-17/h3-13H,14H2,1-2H3,(H,24,25)(H,26,28)