3-(2-chlorophenyl)-5-methyl-N-(1,2,4-triazol-4-ylcarbamothioyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-(1,2,4-triazol-4-ylcarbamothioyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-(1,2,4-triazol-4-ylcarbamothioyl)isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[sulfanylidene-(1,2,4-triazol-4-ylamino)methyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-(1,2,4-triazol-4-ylcarbamothioyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-(1,2,4-triazol-4-ylthiocarbamoyl)isoxazole-4-carboxamide Formula: C14H11ClN6O2S MolecularWeight: 362.79414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NN3C=NN=C3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NN3C=NN=C3

InChI

InChI=1S/C14H11ClN6O2S/c1-8-11(12(20-23-8)9-4-2-3-5-10(9)15)13(22)18-14(24)19-21-6-16-17-7-21/h2-7H,1H3,(H2,18,19,22,24)