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

Systemtic Name: 4-(2-octylsulfanylpyrimidin-5-yl)phenol Openeye Name: 4-(2-octylsulfanylpyrimidin-5-yl)phenol CAS Name: 4-[2-(octylthio)-5-pyrimidinyl]phenol IUPAC Name: 4-(2-octylsulfanylpyrimidin-5-yl)phenol Traditional Name: 4-[2-(octylthio)pyrimidin-5-yl]phenol Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC=C(C=N1)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCSC1=NC=C(C=N1)C2=CC=C(C=C2)O

InChI

InChI=1S/C18H24N2OS/c1-2-3-4-5-6-7-12-22-18-19-13-16(14-20-18)15-8-10-17(21)11-9-15/h8-11,13-14,21H,2-7,12H2,1H3