N-[3-(benzimidazol-1-yl)propyl]-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide Formula: C21H18ClFN4O2 MolecularWeight: 412.844623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H18ClFN4O2/c1-13-18(20(26-29-13)19-14(22)6-4-7-15(19)23)21(28)24-10-5-11-27-12-25-16-8-2-3-9-17(16)27/h2-4,6-9,12H,5,10-11H2,1H3,(H,24,28)