1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-N-(1-methyl-3-pyrazol-1-yl-propyl)triazole-4-carboxamide CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-N-[4-(1-pyrazolyl)butan-2-yl]-4-triazolecarboxamide IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-N-(4-pyrazol-1-ylbutan-2-yl)triazole-4-carboxamide Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-N-(1-methyl-3-pyrazol-1-yl-propyl)triazole-4-carboxamide Formula: C17H18ClFN6O MolecularWeight: 376.815823

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)NC(=O)C2=CN(N=N2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(CCN1C=CC=N1)NC(=O)C2=CN(N=N2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C17H18ClFN6O/c1-12(5-8-24-7-2-6-20-24)21-17(26)16-11-25(23-22-16)10-13-3-4-14(19)9-15(13)18/h2-4,6-7,9,11-12H,5,8,10H2,1H3,(H,21,26)