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

Systemtic Name: 2-(2,4-dimethylphenyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-methyl-triazole-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-[3-(1-imidazolylmethyl)phenyl]-5-methyl-4-triazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-methyltriazole-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-[3-(imidazol-1-ylmethyl)phenyl]-5-methyl-triazole-4-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4)C)C

InChI

InChI=1S/C22H22N6O/c1-15-7-8-20(16(2)11-15)28-25-17(3)21(26-28)22(29)24-19-6-4-5-18(12-19)13-27-10-9-23-14-27/h4-12,14H,13H2,1-3H3,(H,24,29)