(E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(2-pyridylmethyl)acrylamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C(C#N)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)/C=C(\C#N)/C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C23H22N4O2/c1-16-12-18(17(2)27(16)21-7-9-22(29-3)10-8-21)13-19(14-24)23(28)26-15-20-6-4-5-11-25-20/h4-13H,15H2,1-3H3,(H,26,28)/b19-13+