3-(cyclohexylmethylsulfanyl)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; ethanedioic acid

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; ethanedioic acid Openeye Name: 3-(cyclohexylmethylsulfanyl)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(cyclohexylmethylthio)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-(cyclohexylmethylsulfanyl)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(cyclohexylmethylthio)-4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazole; oxalic acid Formula: C17H25N3O4S2 MolecularWeight: 399.5281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC=C(C1)C2=NSN=C2SCC3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCC=C(C1)C2=NSN=C2SCC3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23N3S2.C2H2O4/c1-18-9-5-8-13(10-18)14-15(17-20-16-14)19-11-12-6-3-2-4-7-12;3-1(4)2(5)6/h8,12H,2-7,9-11H2,1H3;(H,3,4)(H,5,6)