4-ethyl-3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-ethyl-5-methyl-1,2,4-triazole CAS Name: 4-ethyl-3-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-ethyl-5-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-ethyl-5-methyl-1,2,4-triazole Formula: C12H15N3S MolecularWeight: 233.3326

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)C

InChI

InChI=1S/C12H15N3S/c1-3-15-10(2)13-14-12(15)16-9-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3