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

Systemtic Name: 3-(2-chlorophenyl)-N-[[2-(4-cyanophenoxy)ethanoylamino]carbamothioyl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-N-[[[2-(4-cyanophenoxy)acetyl]amino]carbamothioyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-N-[[[2-(4-cyanophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-N-[[[2-(4-cyanophenoxy)acetyl]amino]carbamothioyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-[[[2-(4-cyanophenoxy)acetyl]amino]thiocarbamoyl]-5-methyl-isoxazole-4-carboxamide Formula: C21H16ClN5O4S MolecularWeight: 469.90084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H16ClN5O4S/c1-12-18(19(27-31-12)15-4-2-3-5-16(15)22)20(29)24-21(32)26-25-17(28)11-30-14-8-6-13(10-23)7-9-14/h2-9H,11H2,1H3,(H,25,28)(H2,24,26,29,32)