5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-(2-thienyl)pyrrolidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-[[(2S)-2-(2-thienyl)pyrrolidino]methyl]-1,3,4-oxadiazole-2-thione Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CN2C(=S)OC(=N2)C3=CC4=C(C=C3)OCO4)C5=CC=CS5

Isomeric SMILES

C1C[C@H](N(C1)CN2C(=S)OC(=N2)C3=CC4=C(C=C3)OCO4)C5=CC=CS5

InChI

InChI=1S/C18H17N3O3S2/c25-18-21(10-20-7-1-3-13(20)16-4-2-8-26-16)19-17(24-18)12-5-6-14-15(9-12)23-11-22-14/h2,4-6,8-9,13H,1,3,7,10-11H2/t13-/m0/s1