N-(2-cyanoethyl)-2-(6,7-dimethyl-1-benzofuran-3-yl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(6,7-dimethyl-1-benzofuran-3-yl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-(6,7-dimethylbenzofuran-3-yl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(2-cyanoethyl)-2-(6,7-dimethyl-3-benzofuranyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-(6,7-dimethyl-1-benzofuran-3-yl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-(6,7-dimethylbenzofuran-3-yl)-N-(3-pyridylmethyl)acetamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N(CCC#N)CC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)N(CCC#N)CC3=CN=CC=C3)C

InChI

InChI=1S/C21H21N3O2/c1-15-6-7-19-18(14-26-21(19)16(15)2)11-20(25)24(10-4-8-22)13-17-5-3-9-23-12-17/h3,5-7,9,12,14H,4,10-11,13H2,1-2H3