2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 5,7-dimethyl-2-(piperonylthio)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C15H14N4O2S MolecularWeight: 314.36226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=NN12)SCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NC2=NC(=NN12)SCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C15H14N4O2S/c1-9-5-10(2)19-14(16-9)17-15(18-19)22-7-11-3-4-12-13(6-11)21-8-20-12/h3-6H,7-8H2,1-2H3