4-(2-decylsulfanylpyrimidin-5-yl)phenol

Systemtic Name: 4-(2-decylsulfanylpyrimidin-5-yl)phenol Openeye Name: 4-(2-decylsulfanylpyrimidin-5-yl)phenol CAS Name: 4-[2-(decylthio)-5-pyrimidinyl]phenol IUPAC Name: 4-(2-decylsulfanylpyrimidin-5-yl)phenol Traditional Name: 4-[2-(decylthio)pyrimidin-5-yl]phenol Formula: C20H28N2OS MolecularWeight: 344.51412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NC=C(C=N1)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCSC1=NC=C(C=N1)C2=CC=C(C=C2)O

InChI

InChI=1S/C20H28N2OS/c1-2-3-4-5-6-7-8-9-14-24-20-21-15-18(16-22-20)17-10-12-19(23)13-11-17/h10-13,15-16,23H,2-9,14H2,1H3