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

Systemtic Name: 4-phenethyl-3-[(phenylmethylsulfanyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(benzylsulfanylmethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-phenethyl-3-[(phenylmethylthio)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(benzylsulfanylmethyl)-4-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(benzylthio)methyl]-4-phenethyl-1H-1,2,4-triazole-5-thione Formula: C18H19N3S2 MolecularWeight: 341.49356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NNC2=S)CSCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NNC2=S)CSCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3S2/c22-18-20-19-17(14-23-13-16-9-5-2-6-10-16)21(18)12-11-15-7-3-1-4-8-15/h1-10H,11-14H2,(H,20,22)