N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(5-keto-1-phenyl-2-pyrazolin-3-yl)-2-(2-pyrimidylthio)acetamide Formula: C15H13N5O2S MolecularWeight: 327.36102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C15H13N5O2S/c21-13(10-23-15-16-7-4-8-17-15)18-12-9-14(22)20(19-12)11-5-2-1-3-6-11/h1-8H,9-10H2,(H,18,19,21)