4-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-N-phenyl-pyrazole-1-carbothioamide

Systemtic Name: 4-(5-chloranyl-2-oxidanyl-phenyl)carbonyl-N-phenyl-pyrazole-1-carbothioamide Openeye Name: 4-(5-chloro-2-hydroxy-benzoyl)-N-phenyl-pyrazole-1-carbothioamide CAS Name: 4-[(5-chloro-2-hydroxyphenyl)-oxomethyl]-N-phenyl-1-pyrazolecarbothioamide IUPAC Name: 4-(5-chloro-2-hydroxybenzoyl)-N-phenylpyrazole-1-carbothioamide Traditional Name: 4-(5-chloro-2-hydroxy-benzoyl)-N-phenyl-pyrazole-1-carbothioamide Formula: C17H12ClN3O2S MolecularWeight: 357.81408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C17H12ClN3O2S/c18-12-6-7-15(22)14(8-12)16(23)11-9-19-21(10-11)17(24)20-13-4-2-1-3-5-13/h1-10,22H,(H,20,24)