N-(aminocarbonylcarbamothioyl)-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-(aminocarbonylcarbamothioyl)-3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-(carbamoylcarbamothioyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide CAS Name: N-[(carbamoylamino)-sulfanylidenemethyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-(carbamoylcarbamothioyl)-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-(carbamoylthiocarbamoyl)-3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxamide Formula: C13H10ClFN4O3S MolecularWeight: 356.759903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClFN4O3S/c1-5-8(11(20)17-13(23)18-12(16)21)10(19-22-5)9-6(14)3-2-4-7(9)15/h2-4H,1H3,(H4,16,17,18,20,21,23)