N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-methyl-propanamide

Systemtic Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-methyl-propanamide Openeye Name: N-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-2-methyl-propanamide CAS Name: N-[4-cyano-5-(ethylthio)-1-phenyl-3-pyrazolyl]-2-methylpropanamide IUPAC Name: N-(4-cyano-5-ethylsulfanyl-1-phenylpyrazol-3-yl)-2-methylpropanamide Traditional Name: N-[4-cyano-5-(ethylthio)-1-phenyl-pyrazol-3-yl]-2-methyl-propionamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4OS/c1-4-22-16-13(10-17)14(18-15(21)11(2)3)19-20(16)12-8-6-5-7-9-12/h5-9,11H,4H2,1-3H3,(H,18,19,21)