ethyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]hexanoate

Systemtic Name: ethyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]hexanoate Openeye Name: ethyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]hexanoate CAS Name: 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]thio]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]hexanoate Traditional Name: 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]thio]hexanoic acid ethyl ester Formula: C16H25N3O2S2 MolecularWeight: 355.5186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)SC1=NSN=C1C2=CCCN(C2)C

Isomeric SMILES

CCCCC(C(=O)OCC)SC1=NSN=C1C2=CCCN(C2)C

InChI

InChI=1S/C16H25N3O2S2/c1-4-6-9-13(16(20)21-5-2)22-15-14(17-23-18-15)12-8-7-10-19(3)11-12/h8,13H,4-7,9-11H2,1-3H3