5,6-dimethyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5,6-dimethyl-2-(phenylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 2-benzylsulfanyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5,6-dimethyl-2-(phenylmethylthio)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 2-benzylsulfanyl-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 2-(benzylthio)-5,6-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C14H14N4S MolecularWeight: 270.35276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=N2)SCC3=CC=CC=C3)N=C1C

Isomeric SMILES

CC1=CN2C(=NC(=N2)SCC3=CC=CC=C3)N=C1C

InChI

InChI=1S/C14H14N4S/c1-10-8-18-13(15-11(10)2)16-14(17-18)19-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3