(E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)-2-propen-1-one IUPAC Name: (E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(1H-imidazol-2-yl)-1-(2-phenethyl-1H-benzimidazol-4-yl)prop-2-en-1-one Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC3=C(C=CC=C3N2)C(=O)C=CC4=NC=CN4

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC3=C(C=CC=C3N2)C(=O)/C=C/C4=NC=CN4

InChI

InChI=1S/C21H18N4O/c26-18(10-12-19-22-13-14-23-19)16-7-4-8-17-21(16)25-20(24-17)11-9-15-5-2-1-3-6-15/h1-8,10,12-14H,9,11H2,(H,22,23)(H,24,25)/b12-10+