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

Systemtic Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(E)-cinnamyl]-N-[(4,6-dimethylpyrimidin-2-yl)methyl]triazole-4-carboxamide CAS Name: N-[(4,6-dimethyl-2-pyrimidinyl)methyl]-1-[(E)-3-phenylprop-2-enyl]-4-triazolecarboxamide IUPAC Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-1-[(E)-3-phenylprop-2-enyl]triazole-4-carboxamide Traditional Name: 1-[(E)-cinnamyl]-N-[(4,6-dimethylpyrimidin-2-yl)methyl]triazole-4-carboxamide Formula: C19H20N6O MolecularWeight: 348.4017

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)CNC(=O)C2=CN(N=N2)CC=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)CNC(=O)C2=CN(N=N2)C/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C19H20N6O/c1-14-11-15(2)22-18(21-14)12-20-19(26)17-13-25(24-23-17)10-6-9-16-7-4-3-5-8-16/h3-9,11,13H,10,12H2,1-2H3,(H,20,26)/b9-6+