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

Systemtic Name: 4-hexadecylsulfanyl-6-methyl-1H-pyrimidin-2-one Openeye Name: 4-hexadecylsulfanyl-6-methyl-1H-pyrimidin-2-one CAS Name: 4-(hexadecylthio)-6-methyl-1H-pyrimidin-2-one IUPAC Name: 4-hexadecylsulfanyl-6-methyl-1H-pyrimidin-2-one Traditional Name: 4-(cetylthio)-6-methyl-1H-pyrimidin-2-one Formula: C21H38N2OS MolecularWeight: 366.60422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=NC(=O)NC(=C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=NC(=O)NC(=C1)C

InChI

InChI=1S/C21H38N2OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-20-18-19(2)22-21(24)23-20/h18H,3-17H2,1-2H3,(H,22,23,24)