N-[(3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[(3-chloro-2-hydroxy-phenyl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[(3-chloro-2-hydroxyanilino)-sulfanylidenemethyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(3-chloro-2-hydroxyphenyl)carbamothioyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[(3-chloro-2-hydroxy-phenyl)thiocarbamoyl]-1-methyl-pyrazole-3-carboxamide Formula: C12H11ClN4O2S MolecularWeight: 310.75934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)O

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)O

InChI

InChI=1S/C12H11ClN4O2S/c1-17-6-5-9(16-17)11(19)15-12(20)14-8-4-2-3-7(13)10(8)18/h2-6,18H,1H3,(H2,14,15,19,20)