N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(4-pyridylmethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[4-(pyridin-4-ylmethyl)phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[4-(4-pyridylmethyl)phenyl]-2-(2-pyrimidylthio)acetamide Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C18H16N4OS/c23-17(13-24-18-20-8-1-9-21-18)22-16-4-2-14(3-5-16)12-15-6-10-19-11-7-15/h1-11H,12-13H2,(H,22,23)