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

Systemtic Name: ethanedioic acid; 3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(thiophen-2-ylmethylsulfanyl)-1,2,5-thiadiazole Openeye Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(2-thienylmethylsulfanyl)-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(thiophen-2-ylmethylthio)-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(thiophen-2-ylmethylsulfanyl)-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(2-thenylthio)-1,2,5-thiadiazole; oxalic acid Formula: C15H17N3O4S3 MolecularWeight: 399.50818

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC=C(C1)C2=NSN=C2SCC3=CC=CS3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCC=C(C1)C2=NSN=C2SCC3=CC=CS3.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H15N3S3.C2H2O4/c1-16-6-2-4-10(8-16)12-13(15-19-14-12)18-9-11-5-3-7-17-11;3-1(4)2(5)6/h3-5,7H,2,6,8-9H2,1H3;(H,3,4)(H,5,6)