4-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-1,2,4-triazolidin-3-one

Systemtic Name: 4-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-1,2,4-triazolidin-3-one Openeye Name: 4-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-1,2,4-triazolidin-3-one CAS Name: 4-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-2-methyl-1,2,4-triazolidin-3-one IUPAC Name: 4-(5-hexylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-1,2,4-triazolidin-3-one Traditional Name: 4-[5-(hexylthio)-1,3,4-thiadiazol-2-yl]-2-methyl-1,2,4-triazolidin-3-one Formula: C11H19N5OS2 MolecularWeight: 301.43146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NN=C(S1)N2CNN(C2=O)C

Isomeric SMILES

CCCCCCSC1=NN=C(S1)N2CNN(C2=O)C

InChI

InChI=1S/C11H19N5OS2/c1-3-4-5-6-7-18-10-14-13-9(19-10)16-8-12-15(2)11(16)17/h12H,3-8H2,1-2H3