4-ethyl-3-[(phenylmethylsulfanyl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-ethyl-3-[(phenylmethylsulfanyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(benzylsulfanylmethyl)-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-ethyl-3-[(phenylmethylthio)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(benzylsulfanylmethyl)-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(benzylthio)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C12H15N3S2 MolecularWeight: 265.3976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)CSCC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NNC1=S)CSCC2=CC=CC=C2

InChI

InChI=1S/C12H15N3S2/c1-2-15-11(13-14-12(15)16)9-17-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)