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

Systemtic Name: 5-azanyl-N-(3,5-dimethylphenyl)-1-[(4-ethoxyphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(4-ethoxyphenyl)methyl]triazole-4-carboxamide CAS Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(4-ethoxyphenyl)methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-(3,5-dimethylphenyl)-1-[(4-ethoxyphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-amino-N-(3,5-dimethylphenyl)-1-(4-ethoxybenzyl)triazole-4-carboxamide Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NC3=CC(=CC(=C3)C)C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NC3=CC(=CC(=C3)C)C)N

InChI

InChI=1S/C20H23N5O2/c1-4-27-17-7-5-15(6-8-17)12-25-19(21)18(23-24-25)20(26)22-16-10-13(2)9-14(3)11-16/h5-11H,4,12,21H2,1-3H3,(H,22,26)