5-[(E)-4-(1H-1,2,4-triazol-5-ylsulfanyl)but-2-enyl]sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-[(E)-4-(1H-1,2,4-triazol-5-ylsulfanyl)but-2-enyl]sulfanyl-1H-1,2,4-triazole Openeye Name: 5-[(E)-4-(1H-1,2,4-triazol-5-ylsulfanyl)but-2-enyl]sulfanyl-1H-1,2,4-triazole CAS Name: 5-[[(E)-4-(1H-1,2,4-triazol-5-ylthio)but-2-enyl]thio]-1H-1,2,4-triazole IUPAC Name: 5-[(E)-4-(1H-1,2,4-triazol-5-ylsulfanyl)but-2-enyl]sulfanyl-1H-1,2,4-triazole Traditional Name: 5-[[(E)-4-(1H-1,2,4-triazol-5-ylthio)but-2-enyl]thio]-1H-1,2,4-triazole Formula: C8H10N6S2 MolecularWeight: 254.3352

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)SCC=CCSC2=NC=NN2

Isomeric SMILES

C1=NNC(=N1)SC/C=C/CSC2=NC=NN2

InChI

InChI=1S/C8H10N6S2/c1(3-15-7-9-5-11-13-7)2-4-16-8-10-6-12-14-8/h1-2,5-6H,3-4H2,(H,9,11,13)(H,10,12,14)/b2-1+