4-phenyl-3-(2-pyrrolidin-1-ylsulfonylethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-phenyl-3-(2-pyrrolidin-1-ylsulfonylethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-phenyl-3-(2-pyrrolidin-1-ylsulfonylethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-phenyl-3-[2-(1-pyrrolidinylsulfonyl)ethyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-phenyl-3-(2-pyrrolidin-1-ylsulfonylethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenyl-3-(2-pyrrolidinosulfonylethyl)-1H-1,2,4-triazole-5-thione Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)CCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)CCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C14H18N4O2S2/c19-22(20,17-9-4-5-10-17)11-8-13-15-16-14(21)18(13)12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,16,21)