2-hexadecylsulfanyl-3-methyl-quinoxaline

Systemtic Name: 2-hexadecylsulfanyl-3-methyl-quinoxaline Openeye Name: 2-hexadecylsulfanyl-3-methyl-quinoxaline CAS Name: 2-(hexadecylthio)-3-methylquinoxaline IUPAC Name: 2-hexadecylsulfanyl-3-methylquinoxaline Traditional Name: 2-(cetylthio)-3-methyl-quinoxaline Formula: C25H40N2S MolecularWeight: 400.6635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=NC2=CC=CC=C2N=C1C

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=NC2=CC=CC=C2N=C1C

InChI

InChI=1S/C25H40N2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-28-25-22(2)26-23-19-16-17-20-24(23)27-25/h16-17,19-20H,3-15,18,21H2,1-2H3