3-(azocan-1-ium-1-ylmethyl)-5-(furan-2-yl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-(azocan-1-ium-1-ylmethyl)-5-(furan-2-yl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-(azocan-1-ium-1-ylmethyl)-5-(2-furyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-(1-azocan-1-iumylmethyl)-5-(2-furanyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-(azocan-1-ium-1-ylmethyl)-5-(furan-2-yl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-(azocan-1-ium-1-ylmethyl)-5-(2-furyl)-1,3,4-oxadiazole-2-thione Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)CN2C(=S)OC(=N2)C3=CC=CO3

Isomeric SMILES

C1CCC[NH+](CCC1)CN2C(=S)OC(=N2)C3=CC=CO3

InChI

InChI=1S/C14H19N3O2S/c20-14-17(11-16-8-4-2-1-3-5-9-16)15-13(19-14)12-7-6-10-18-12/h6-7,10H,1-5,8-9,11H2/p+1