N-hexadecyl-2-methylsulfanyl-imidazo[1,5-a][1,3,5]triazin-4-amine

Systemtic Name: N-hexadecyl-2-methylsulfanyl-imidazo[1,5-a][1,3,5]triazin-4-amine Openeye Name: N-hexadecyl-2-methylsulfanyl-imidazo[1,5-a][1,3,5]triazin-4-amine CAS Name: N-hexadecyl-2-(methylthio)-4-imidazo[1,5-a][1,3,5]triazinamine IUPAC Name: N-hexadecyl-2-methylsulfanylimidazo[1,5-a][1,3,5]triazin-4-amine Traditional Name: cetyl-[2-(methylthio)imidazo[1,5-a][1,3,5]triazin-4-yl]amine Formula: C22H39N5S MolecularWeight: 405.64356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC(=NC2=CN=CN21)SC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC(=NC2=CN=CN21)SC

InChI

InChI=1S/C22H39N5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-21-26-22(28-2)25-20-18-23-19-27(20)21/h18-19H,3-17H2,1-2H3,(H,24,25,26)