5-methyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-methyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-methyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-methyl-3-(2-phenoxyethylthio)-1H-1,2,4-triazole IUPAC Name: 5-methyl-3-(2-phenoxyethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-methyl-3-(2-phenoxyethylthio)-1H-1,2,4-triazole Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCCOC2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NN1)SCCOC2=CC=CC=C2

InChI

InChI=1S/C11H13N3OS/c1-9-12-11(14-13-9)16-8-7-15-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,12,13,14)