5-methylsulfanyl-2-(phenylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-c]pyrimidine

Systemtic Name: 5-methylsulfanyl-2-(phenylmethylsulfanyl)-3H-[1,2,4]triazolo[4,3-c]pyrimidine Openeye Name: 2-benzylsulfanyl-5-methylsulfanyl-3H-[1,2,4]triazolo[4,3-c]pyrimidine CAS Name: 5-(methylthio)-2-(phenylmethylthio)-3H-[1,2,4]triazolo[4,3-c]pyrimidine IUPAC Name: 2-benzylsulfanyl-5-methylsulfanyl-3H-[1,2,4]triazolo[4,3-c]pyrimidine Traditional Name: 2-(benzylthio)-5-(methylthio)-3H-[1,2,4]triazolo[4,3-c]pyrimidine Formula: C13H14N4S2 MolecularWeight: 290.40706

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC2=NN(CN21)SCC3=CC=CC=C3

Isomeric SMILES

CSC1=NC=CC2=NN(CN21)SCC3=CC=CC=C3

InChI

InChI=1S/C13H14N4S2/c1-18-13-14-8-7-12-15-17(10-16(12)13)19-9-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3