N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-phenoxy-ethanamide

Systemtic Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-phenoxy-ethanamide Openeye Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-phenoxy-acetamide CAS Name: N-[4-cyano-5-(ethylthio)-1-phenyl-3-pyrazolyl]-2-phenoxyacetamide IUPAC Name: N-(4-cyano-5-ethylsulfanyl-1-phenylpyrazol-3-yl)-2-phenoxyacetamide Traditional Name: N-[4-cyano-5-(ethylthio)-1-phenyl-pyrazol-3-yl]-2-phenoxy-acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NN1C2=CC=CC=C2)NC(=O)COC3=CC=CC=C3)C#N

Isomeric SMILES

CCSC1=C(C(=NN1C2=CC=CC=C2)NC(=O)COC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H18N4O2S/c1-2-27-20-17(13-21)19(23-24(20)15-9-5-3-6-10-15)22-18(25)14-26-16-11-7-4-8-12-16/h3-12H,2,14H2,1H3,(H,22,23,25)