2-(2,4-dimethylphenyl)-5-methyl-N-[3-(propanoylamino)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-5-methyl-N-[3-(propanoylamino)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-5-methyl-N-[3-(propanoylamino)phenyl]triazole-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-5-methyl-N-[3-(1-oxopropylamino)phenyl]-4-triazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-5-methyl-N-[3-(propanoylamino)phenyl]triazole-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-5-methyl-N-(3-propionamidophenyl)triazole-4-carboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=NN(N=C2C)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=NN(N=C2C)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H23N5O2/c1-5-19(27)22-16-7-6-8-17(12-16)23-21(28)20-15(4)24-26(25-20)18-10-9-13(2)11-14(18)3/h6-12H,5H2,1-4H3,(H,22,27)(H,23,28)