6-methyl-4-octadecylsulfanyl-1H-pyrimidin-2-one

Systemtic Name: 6-methyl-4-octadecylsulfanyl-1H-pyrimidin-2-one Openeye Name: 6-methyl-4-octadecylsulfanyl-1H-pyrimidin-2-one CAS Name: 6-methyl-4-(octadecylthio)-1H-pyrimidin-2-one IUPAC Name: 6-methyl-4-octadecylsulfanyl-1H-pyrimidin-2-one Traditional Name: 6-methyl-4-(stearylthio)-1H-pyrimidin-2-one Formula: C23H42N2OS MolecularWeight: 394.65738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=NC(=O)NC(=C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=NC(=O)NC(=C1)C

InChI

InChI=1S/C23H42N2OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-22-20-21(2)24-23(26)25-22/h20H,3-19H2,1-2H3,(H,24,25,26)