5-chloranyl-N-[[4-chloranyl-3-(3-cyano-5-prop-1-ynyl-phenoxy)-2-fluoranyl-phenyl]methyl]-1H-imidazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-chloranyl-3-(3-cyano-5-prop-1-ynyl-phenoxy)-2-fluoranyl-phenyl]methyl]-1H-imidazole-4-carboxamide Openeye Name: 5-chloro-N-[[4-chloro-3-(3-cyano-5-prop-1-ynyl-phenoxy)-2-fluoro-phenyl]methyl]-1H-imidazole-4-carboxamide CAS Name: 5-chloro-N-[[4-chloro-3-(3-cyano-5-prop-1-ynylphenoxy)-2-fluorophenyl]methyl]-1H-imidazole-4-carboxamide IUPAC Name: 5-chloro-N-[[4-chloro-3-(3-cyano-5-prop-1-ynylphenoxy)-2-fluorophenyl]methyl]-1H-imidazole-4-carboxamide Traditional Name: 5-chloro-N-[4-chloro-3-(3-cyano-5-prop-1-ynyl-phenoxy)-2-fluoro-benzyl]-1H-imidazole-4-carboxamide Formula: C21H13Cl2FN4O2 MolecularWeight: 443.257923

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CC(=C1)OC2=C(C=CC(=C2F)CNC(=O)C3=C(NC=N3)Cl)Cl)C#N

Isomeric SMILES

CC#CC1=CC(=CC(=C1)OC2=C(C=CC(=C2F)CNC(=O)C3=C(NC=N3)Cl)Cl)C#N

InChI

InChI=1S/C21H13Cl2FN4O2/c1-2-3-12-6-13(9-25)8-15(7-12)30-19-16(22)5-4-14(17(19)24)10-26-21(29)18-20(23)28-11-27-18/h4-8,11H,10H2,1H3,(H,26,29)(H,27,28)