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

Systemtic Name: 2-(2,4-dimethylphenyl)-N-(4-fluoranyl-3-nitro-phenyl)-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-(4-fluoro-3-nitro-phenyl)-5-methyl-triazole-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-(4-fluoro-3-nitrophenyl)-5-methyl-4-triazolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-(4-fluoro-3-nitrophenyl)-5-methyltriazole-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-(4-fluoro-3-nitro-phenyl)-5-methyl-triazole-4-carboxamide Formula: C18H16FN5O3 MolecularWeight: 369.349743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H16FN5O3/c1-10-4-7-15(11(2)8-10)23-21-12(3)17(22-23)18(25)20-13-5-6-14(19)16(9-13)24(26)27/h4-9H,1-3H3,(H,20,25)