2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile

Systemtic Name: 2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile Openeye Name: 2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile CAS Name: 2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenenitrile IUPAC Name: 2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enenitrile Traditional Name: 2-(1H-benzimidazol-2-yl)-3-[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]acrylonitrile Formula: C22H17BrN4 MolecularWeight: 417.30118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C=C(C#N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)Br)C)C=C(C#N)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H17BrN4/c1-14-10-16(15(2)27(14)19-7-5-6-18(23)12-19)11-17(13-24)22-25-20-8-3-4-9-21(20)26-22/h3-12H,1-2H3,(H,25,26)