2-(cyanomethylsulfanyl)-N-(1H-pyrazol-4-yl)benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-(1H-pyrazol-4-yl)benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-(1H-pyrazol-4-yl)benzamide CAS Name: 2-(cyanomethylthio)-N-(1H-pyrazol-4-yl)benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-(1H-pyrazol-4-yl)benzamide Traditional Name: 2-(cyanomethylthio)-N-(1H-pyrazol-4-yl)benzamide Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CNN=C2)SCC#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CNN=C2)SCC#N

InChI

InChI=1S/C12H10N4OS/c13-5-6-18-11-4-2-1-3-10(11)12(17)16-9-7-14-15-8-9/h1-4,7-8H,6H2,(H,14,15)(H,16,17)