3-(1-methyl-2H-pyridin-3-yl)-4-octylsulfanyl-1,2,5-thiadiazole

Systemtic Name: 3-(1-methyl-2H-pyridin-3-yl)-4-octylsulfanyl-1,2,5-thiadiazole Openeye Name: 3-(1-methyl-2H-pyridin-3-yl)-4-octylsulfanyl-1,2,5-thiadiazole CAS Name: 3-(1-methyl-2H-pyridin-3-yl)-4-(octylthio)-1,2,5-thiadiazole IUPAC Name: 3-(1-methyl-2H-pyridin-3-yl)-4-octylsulfanyl-1,2,5-thiadiazole Traditional Name: 3-(1-methyl-2H-pyridin-3-yl)-4-(octylthio)-1,2,5-thiadiazole Formula: C16H25N3S2 MolecularWeight: 323.5198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NSN=C1C2=CC=CN(C2)C

Isomeric SMILES

CCCCCCCCSC1=NSN=C1C2=CC=CN(C2)C

InChI

InChI=1S/C16H25N3S2/c1-3-4-5-6-7-8-12-20-16-15(17-21-18-16)14-10-9-11-19(2)13-14/h9-11H,3-8,12-13H2,1-2H3