4-(oxolan-2-ylmethyl)-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(oxolan-2-ylmethyl)-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4,5,6,7-tetrahydrobenzothiophen-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-oxolanylmethyl)-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(oxolan-2-ylmethyl)-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4,5,6,7-tetrahydrobenzothiophen-3-yl)-4-(tetrahydrofurfuryl)-1H-1,2,4-triazole-5-thione Formula: C15H19N3OS2 MolecularWeight: 321.46086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C3=NNC(=S)N3CC4CCCO4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C3=NNC(=S)N3CC4CCCO4

InChI

InChI=1S/C15H19N3OS2/c20-15-17-16-14(18(15)8-10-4-3-7-19-10)12-9-21-13-6-2-1-5-11(12)13/h9-10H,1-8H2,(H,17,20)