2-(2,4-dimethylphenyl)-5-methyl-N-(2-morpholin-4-ylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-5-methyl-N-(2-morpholin-4-ylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-5-methyl-N-(2-morpholinophenyl)triazole-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-5-methyl-N-[2-(4-morpholinyl)phenyl]-4-triazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-5-methyl-N-(2-morpholin-4-ylphenyl)triazole-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-5-methyl-N-(2-morpholinophenyl)triazole-4-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC=CC=C3N4CCOCC4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC=CC=C3N4CCOCC4)C)C

InChI

InChI=1S/C22H25N5O2/c1-15-8-9-19(16(2)14-15)27-24-17(3)21(25-27)22(28)23-18-6-4-5-7-20(18)26-10-12-29-13-11-26/h4-9,14H,10-13H2,1-3H3,(H,23,28)