3-(4-methylphenyl)-7-methylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidine

Systemtic Name: 3-(4-methylphenyl)-7-methylsulfanyl-[1,2,3]triazolo[4,5-d]pyrimidine Openeye Name: 7-methylsulfanyl-3-(p-tolyl)triazolo[4,5-d]pyrimidine CAS Name: 3-(4-methylphenyl)-7-(methylthio)triazolo[4,5-d]pyrimidine IUPAC Name: 3-(4-methylphenyl)-7-methylsulfanyltriazolo[4,5-d]pyrimidine Traditional Name: 7-(methylthio)-3-(p-tolyl)triazolo[4,5-d]pyrimidine Formula: C12H11N5S MolecularWeight: 257.31424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=NC=N3)SC)N=N2

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=NC=N3)SC)N=N2

InChI

InChI=1S/C12H11N5S/c1-8-3-5-9(6-4-8)17-11-10(15-16-17)12(18-2)14-7-13-11/h3-7H,1-2H3