N-(5-phenyl-1H-pyrazol-3-yl)-2-sulfanyl-ethanamide

Systemtic Name: N-(5-phenyl-1H-pyrazol-3-yl)-2-sulfanyl-ethanamide Openeye Name: N-(5-phenyl-1H-pyrazol-3-yl)-2-sulfanyl-acetamide CAS Name: 2-mercapto-N-(5-phenyl-1H-pyrazol-3-yl)acetamide IUPAC Name: N-(5-phenyl-1H-pyrazol-3-yl)-2-sulfanylacetamide Traditional Name: 2-mercapto-N-(5-phenyl-1H-pyrazol-3-yl)acetamide Formula: C11H11N3OS MolecularWeight: 233.28954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2)NC(=O)CS

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2)NC(=O)CS

InChI

InChI=1S/C11H11N3OS/c15-11(7-16)12-10-6-9(13-14-10)8-4-2-1-3-5-8/h1-6,16H,7H2,(H2,12,13,14,15)