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

Systemtic Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-N-(2-pyridylmethyl)acrylamide Formula: C22H23N3O MolecularWeight: 345.43752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=CC(=O)NCC3=CC=CC=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C/C(=O)NCC3=CC=CC=N3)C

InChI

InChI=1S/C22H23N3O/c1-16-7-10-21(11-8-16)25-17(2)14-19(18(25)3)9-12-22(26)24-15-20-6-4-5-13-23-20/h4-14H,15H2,1-3H3,(H,24,26)/b12-9+