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

Systemtic Name: 3-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-4-hexoxy-1,2,5-thiadiazole; ethanedioic acid Openeye Name: 3-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-4-hexoxy-1,2,5-thiadiazole; oxalic acid CAS Name: 3-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-4-hexoxy-1,2,5-thiadiazole; oxalic acid IUPAC Name: 3-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-4-hexoxy-1,2,5-thiadiazole; oxalic acid Traditional Name: 3-(1,4-dimethyl-3,6-dihydro-2H-pyridin-5-yl)-4-hexoxy-1,2,5-thiadiazole; oxalic acid Formula: C17H27N3O5S MolecularWeight: 385.47838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=NSN=C1C2=C(CCN(C2)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCOC1=NSN=C1C2=C(CCN(C2)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H25N3OS.C2H2O4/c1-4-5-6-7-10-19-15-14(16-20-17-15)13-11-18(3)9-8-12(13)2;3-1(4)2(5)6/h4-11H2,1-3H3;(H,3,4)(H,5,6)