(E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]but-2-enediamide

Systemtic Name: (E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]but-2-enediamide Openeye Name: (E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]but-2-enediamide CAS Name: (E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]-2-butenediamide IUPAC Name: (E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]but-2-enediamide Traditional Name: (E)-N,N'-bis[4-(1H-benzimidazol-2-yl)phenyl]but-2-enediamide Formula: C30H22N6O2 MolecularWeight: 498.53468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)C=CC(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)/C=C/C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C30H22N6O2/c37-27(31-21-13-9-19(10-14-21)29-33-23-5-1-2-6-24(23)34-29)17-18-28(38)32-22-15-11-20(12-16-22)30-35-25-7-3-4-8-26(25)36-30/h1-18H,(H,31,37)(H,32,38)(H,33,34)(H,35,36)/b18-17+