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

Systemtic Name: N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(E)-cinnamyl]-N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]triazole-4-carboxamide CAS Name: N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-4-triazolecarboxamide IUPAC Name: N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]triazole-4-carboxamide Traditional Name: 1-[(E)-cinnamyl]-N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]triazole-4-carboxamide Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)CNC(=O)C3=CN(N=N3)CC=CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)CNC(=O)C3=CN(N=N3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H20N6O2/c1-29-16-9-10-17-18(12-16)24-20(23-17)13-22-21(28)19-14-27(26-25-19)11-5-8-15-6-3-2-4-7-15/h2-10,12,14H,11,13H2,1H3,(H,22,28)(H,23,24)/b8-5+