N-[5-oxidanylidene-2-(phenylcarbamothioyl)-1H-pyrazol-4-yl]benzamide

Systemtic Name: N-[5-oxidanylidene-2-(phenylcarbamothioyl)-1H-pyrazol-4-yl]benzamide Openeye Name: N-[5-oxo-2-(phenylcarbamothioyl)-1H-pyrazol-4-yl]benzamide CAS Name: N-[2-[anilino(sulfanylidene)methyl]-5-oxo-1H-pyrazol-4-yl]benzamide IUPAC Name: N-[5-oxo-2-(phenylcarbamothioyl)-1H-pyrazol-4-yl]benzamide Traditional Name: N-[3-keto-1-(phenylthiocarbamoyl)-3-pyrazolin-4-yl]benzamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CN(NC2=O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CN(NC2=O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H14N4O2S/c22-15(12-7-3-1-4-8-12)19-14-11-21(20-16(14)23)17(24)18-13-9-5-2-6-10-13/h1-11H,(H,18,24)(H,19,22)(H,20,23)