N-(1-phenyl-2-pyrazol-1-yl-ethyl)-2-pyridin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(1-phenyl-2-pyrazol-1-yl-ethyl)-2-pyridin-4-ylsulfanyl-ethanamide Openeye Name: N-(1-phenyl-2-pyrazol-1-yl-ethyl)-2-(4-pyridylsulfanyl)acetamide CAS Name: N-[1-phenyl-2-(1-pyrazolyl)ethyl]-2-(pyridin-4-ylthio)acetamide IUPAC Name: N-(1-phenyl-2-pyrazol-1-ylethyl)-2-pyridin-4-ylsulfanylacetamide Traditional Name: N-(1-phenyl-2-pyrazol-1-yl-ethyl)-2-(4-pyridylthio)acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN2C=CC=N2)NC(=O)CSC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CN2C=CC=N2)NC(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C18H18N4OS/c23-18(14-24-16-7-10-19-11-8-16)21-17(13-22-12-4-9-20-22)15-5-2-1-3-6-15/h1-12,17H,13-14H2,(H,21,23)