4-methyl-3-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-methyl-3-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-methyl-1,2,4-triazole CAS Name: 4-methyl-3-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-methyl-1,2,4-triazole Formula: C10H11N3S MolecularWeight: 205.27944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=CC=C2

Isomeric SMILES

CN1C=NN=C1SCC2=CC=CC=C2

InChI

InChI=1S/C10H11N3S/c1-13-8-11-12-10(13)14-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3