(E)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[2-methyl-4-(1-pyrrolidinyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-4-pyrrolidin-1-ylphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-4-pyrrolidino-phenyl)acrylonitrile Formula: C21H20N4 MolecularWeight: 328.4103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)C=C(C#N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)/C=C(\C#N)/C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H20N4/c1-15-12-18(25-10-4-5-11-25)9-8-16(15)13-17(14-22)21-23-19-6-2-3-7-20(19)24-21/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,24)/b17-13+