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

Systemtic Name: 5-azanyl-N-(3,5-dimethylphenyl)-1-[(2,5-dimethylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(2,5-dimethylphenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(2,5-dimethylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(2,5-dimethylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(2,5-dimethylbenzyl)-N-(3,5-dimethylphenyl)triazole-4-carboxamide Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C(=C(N=N2)C(=O)NC3=CC(=CC(=C3)C)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C(=C(N=N2)C(=O)NC3=CC(=CC(=C3)C)C)N

InChI

InChI=1S/C20H23N5O/c1-12-5-6-15(4)16(8-12)11-25-19(21)18(23-24-25)20(26)22-17-9-13(2)7-14(3)10-17/h5-10H,11,21H2,1-4H3,(H,22,26)