3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[3-(thiophene-2-carbonylamino)phenyl]isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[3-(thiophene-2-carbonylamino)phenyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[3-(2-thenoylamino)phenyl]isoxazole-4-carboxamide Formula: C22H15ClFN3O3S MolecularWeight: 455.889203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H15ClFN3O3S/c1-12-18(20(27-30-12)19-15(23)7-3-8-16(19)24)22(29)26-14-6-2-5-13(11-14)25-21(28)17-9-4-10-31-17/h2-11H,1H3,(H,25,28)(H,26,29)