6-hexadecylsulfanyl-1H-pyrimidin-2-one

Systemtic Name: 6-hexadecylsulfanyl-1H-pyrimidin-2-one Openeye Name: 6-hexadecylsulfanyl-1H-pyrimidin-2-one CAS Name: 6-(hexadecylthio)-1H-pyrimidin-2-one IUPAC Name: 6-hexadecylsulfanyl-1H-pyrimidin-2-one Traditional Name: 6-(cetylthio)-1H-pyrimidin-2-one Formula: C20H36N2OS MolecularWeight: 352.57764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=CC=NC(=O)N1

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=CC=NC(=O)N1

InChI

InChI=1S/C20H36N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-19-16-17-21-20(23)22-19/h16-17H,2-15,18H2,1H3,(H,21,22,23)