(E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=C(C#N)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=C(\C#N)/C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O/c1-14(2)23-15(3)10-18(16(23)4)11-19(12-21)20(24)22-13-17-8-6-5-7-9-17/h5-11,14H,13H2,1-4H3,(H,22,24)/b19-11+