(E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide Openeye Name: (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acrylamide Formula: C26H25N5O MolecularWeight: 423.5096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C26H25N5O/c1-4-13-31-17(2)14-19(18(31)3)15-20(16-27)26(32)30-22-10-6-5-9-21(22)25-28-23-11-7-8-12-24(23)29-25/h5-12,14-15H,4,13H2,1-3H3,(H,28,29)(H,30,32)/b20-15+