3-decylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine

Systemtic Name: 3-decylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine Openeye Name: 3-decylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine CAS Name: 3-(decylthio)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine IUPAC Name: 3-decylsulfanyl-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine Traditional Name: 3-(decylthio)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine Formula: C17H28N4S MolecularWeight: 320.49602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=NN=C2N1C(=CC(=N2)C)C

Isomeric SMILES

CCCCCCCCCCSC1=NN=C2N1C(=CC(=N2)C)C

InChI

InChI=1S/C17H28N4S/c1-4-5-6-7-8-9-10-11-12-22-17-20-19-16-18-14(2)13-15(3)21(16)17/h13H,4-12H2,1-3H3