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

Systemtic Name: 5-azanyl-1-[(2,5-dimethylphenyl)methyl]-N-(4-fluoranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-fluoro-2-methyl-phenyl)triazole-4-carboxamide CAS Name: 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-fluoro-2-methylphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-fluoro-2-methylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(2,5-dimethylbenzyl)-N-(4-fluoro-2-methyl-phenyl)triazole-4-carboxamide Formula: C19H20FN5O MolecularWeight: 353.393403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN5O/c1-11-4-5-12(2)14(8-11)10-25-18(21)17(23-24-25)19(26)22-16-7-6-15(20)9-13(16)3/h4-9H,10,21H2,1-3H3,(H,22,26)