4-chloranyl-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[(3-hydroxyanilino)-sulfanylidenemethyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(3-hydroxyphenyl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[(3-hydroxyphenyl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C13H13ClN4O2S MolecularWeight: 324.78592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC(=CC=C2)O)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC(=CC=C2)O)C

InChI

InChI=1S/C13H13ClN4O2S/c1-7-10(14)11(18(2)17-7)12(20)16-13(21)15-8-4-3-5-9(19)6-8/h3-6,19H,1-2H3,(H2,15,16,20,21)