(2R)-N-(4-cyano-5-methylsulfanyl-1-phenyl-pyrazol-3-yl)oxolane-2-carboxamide

Systemtic Name: (2R)-N-(4-cyano-5-methylsulfanyl-1-phenyl-pyrazol-3-yl)oxolane-2-carboxamide Openeye Name: (2R)-N-(4-cyano-5-methylsulfanyl-1-phenyl-pyrazol-3-yl)tetrahydrofuran-2-carboxamide CAS Name: (2R)-N-[4-cyano-5-(methylthio)-1-phenyl-3-pyrazolyl]-2-oxolanecarboxamide IUPAC Name: (2R)-N-(4-cyano-5-methylsulfanyl-1-phenylpyrazol-3-yl)oxolane-2-carboxamide Traditional Name: (2R)-N-[4-cyano-5-(methylthio)-1-phenyl-pyrazol-3-yl]tetrahydrofuran-2-carboxamide Formula: C16H16N4O2S MolecularWeight: 328.38884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NN1C2=CC=CC=C2)NC(=O)C3CCCO3)C#N

Isomeric SMILES

CSC1=C(C(=NN1C2=CC=CC=C2)NC(=O)[C@H]3CCCO3)C#N

InChI

InChI=1S/C16H16N4O2S/c1-23-16-12(10-17)14(18-15(21)13-8-5-9-22-13)19-20(16)11-6-3-2-4-7-11/h2-4,6-7,13H,5,8-9H2,1H3,(H,18,19,21)/t13-/m1/s1