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

Systemtic Name: 4-phenyl-3-[(phenylmethylsulfanyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(benzylsulfanylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-phenyl-3-[(phenylmethylthio)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(benzylsulfanylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(benzylthio)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H15N3S2 MolecularWeight: 313.4404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C16H15N3S2/c20-16-18-17-15(19(16)14-9-5-2-6-10-14)12-21-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,18,20)