5-azanyl-1-[[3-chloranyl-4-(4-fluorophenyl)carbonyl-5-methyl-phenyl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[[3-chloranyl-4-(4-fluorophenyl)carbonyl-5-methyl-phenyl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[[3-chloro-4-(4-fluorobenzoyl)-5-methyl-phenyl]methyl]triazole-4-carboxamide CAS Name: 5-amino-1-[[3-chloro-4-[(4-fluorophenyl)-oxomethyl]-5-methylphenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[[3-chloro-4-(4-fluorobenzoyl)-5-methylphenyl]methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-[3-chloro-4-(4-fluorobenzoyl)-5-methyl-benzyl]triazole-4-carboxamide Formula: C18H15ClFN5O2 MolecularWeight: 387.795403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClFN5O2/c1-9-6-10(8-25-17(21)15(18(22)27)23-24-25)7-13(19)14(9)16(26)11-2-4-12(20)5-3-11/h2-7H,8,21H2,1H3,(H2,22,27)