N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)pyrrol-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)pyrrol-2-yl]pyridine-3-carboxamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)pyrrol-2-yl]pyridine-3-carboxamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)-2-pyrrolyl]-3-pyridinecarboxamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)pyrrol-2-yl]pyridine-3-carboxamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-(1-phenylethyl)pyrrol-2-yl]nicotinamide Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)C2=CN=CC=C2)C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)C2=CN=CC=C2)C(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H20N4O/c1-14-15(2)25(16(3)17-8-5-4-6-9-17)20(19(14)12-22)24-21(26)18-10-7-11-23-13-18/h4-11,13,16H,1-3H3,(H,24,26)