N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(E)-cinnamyl]-N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]triazole-4-carboxamide CAS Name: N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-4-triazolecarboxamide IUPAC Name: N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]triazole-4-carboxamide Traditional Name: 1-[(E)-cinnamyl]-N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]triazole-4-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)CNC(=O)C3=CN(N=N3)CC=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CNC(=O)C3=CN(N=N3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H22N6O/c1-15-11-18-19(12-16(15)2)25-21(24-18)13-23-22(29)20-14-28(27-26-20)10-6-9-17-7-4-3-5-8-17/h3-9,11-12,14H,10,13H2,1-2H3,(H,23,29)(H,24,25)/b9-6+