N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)triazole-4-carboxamide CAS Name: N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-4-triazolecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)triazole-4-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-5-methyl-1-(3-phenylanthranil-5-yl)triazole-4-carboxamide Formula: C25H21N5O2 MolecularWeight: 423.46654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=C(N(N=N2)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=C(N(N=N2)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5)C

InChI

InChI=1S/C25H21N5O2/c1-15-9-10-16(2)22(13-15)26-25(31)23-17(3)30(29-27-23)19-11-12-21-20(14-19)24(32-28-21)18-7-5-4-6-8-18/h4-14H,1-3H3,(H,26,31)