3-(1-azabicyclo[3.2.1]octan-6-yl)-4-pentylsulfanyl-1,2,5-thiadiazole; ethanedioic acid

Systemtic Name: 3-(1-azabicyclo[3.2.1]octan-6-yl)-4-pentylsulfanyl-1,2,5-thiadiazole; ethanedioic acid Openeye Name: 3-(1-azabicyclo[3.2.1]octan-6-yl)-4-pentylsulfanyl-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(1-azabicyclo[3.2.1]octan-6-yl)-4-(pentylthio)-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-(1-azabicyclo[3.2.1]octan-6-yl)-4-pentylsulfanyl-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(amylthio)-4-(1-azabicyclo[3.2.1]octan-6-yl)-1,2,5-thiadiazole; oxalic acid Formula: C16H25N3O4S2 MolecularWeight: 387.5174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NSN=C1C2CN3CCCC2C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCSC1=NSN=C1C2CN3CCCC2C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H23N3S2.C2H2O4/c1-2-3-4-8-18-14-13(15-19-16-14)12-10-17-7-5-6-11(12)9-17;3-1(4)2(5)6/h11-12H,2-10H2,1H3;(H,3,4)(H,5,6)