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

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[(phenylmethyl)carbamothioyl]-1,2-oxazole-4-carboxamide Openeye Name: N-(benzylcarbamothioyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]-4-isoxazolecarboxamide IUPAC Name: N-(benzylcarbamothioyl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-(benzylthiocarbamoyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide Formula: C19H15ClFN3O2S MolecularWeight: 403.857703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C19H15ClFN3O2S/c1-11-15(17(24-26-11)16-13(20)8-5-9-14(16)21)18(25)23-19(27)22-10-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H2,22,23,25,27)