3-(2-chlorophenyl)-5-methyl-N-[(3-methylsulfanylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-[(3-methylsulfanylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-[(3-methylsulfanylphenyl)carbamothioyl]isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[[3-(methylthio)anilino]-sulfanylidenemethyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-[(3-methylsulfanylphenyl)carbamothioyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-[[3-(methylthio)phenyl]thiocarbamoyl]isoxazole-4-carboxamide Formula: C19H16ClN3O2S2 MolecularWeight: 417.93224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C19H16ClN3O2S2/c1-11-16(17(23-25-11)14-8-3-4-9-15(14)20)18(24)22-19(26)21-12-6-5-7-13(10-12)27-2/h3-10H,1-2H3,(H2,21,22,24,26)