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

Systemtic Name: 6-octadecylsulfanyl-1H-pyrimidin-2-one Openeye Name: 6-octadecylsulfanyl-1H-pyrimidin-2-one CAS Name: 6-(octadecylthio)-1H-pyrimidin-2-one IUPAC Name: 6-octadecylsulfanyl-1H-pyrimidin-2-one Traditional Name: 6-(stearylthio)-1H-pyrimidin-2-one Formula: C22H40N2OS MolecularWeight: 380.6308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=CC=NC(=O)N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=CC=NC(=O)N1

InChI

InChI=1S/C22H40N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-26-21-18-19-23-22(25)24-21/h18-19H,2-17,20H2,1H3,(H,23,24,25)