N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]valeramide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CN=C3C(=C2)C=CN3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CN=C3C(=C2)C=CN3)C(=O)NCC#N

InChI

InChI=1S/C21H22N4O/c1-14(2)10-19(21(26)24-9-7-22)16-5-3-4-15(11-16)18-12-17-6-8-23-20(17)25-13-18/h3-6,8,11-14,19H,9-10H2,1-2H3,(H,23,25)(H,24,26)