5-[(E)-3-chloranylbut-2-enyl]sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-[(E)-3-chloranylbut-2-enyl]sulfanyl-1H-1,2,4-triazole Openeye Name: 5-[(E)-3-chlorobut-2-enyl]sulfanyl-1H-1,2,4-triazole CAS Name: 5-[[(E)-3-chlorobut-2-enyl]thio]-1H-1,2,4-triazole IUPAC Name: 5-[(E)-3-chlorobut-2-enyl]sulfanyl-1H-1,2,4-triazole Traditional Name: 5-[[(E)-3-chlorobut-2-enyl]thio]-1H-1,2,4-triazole Formula: C6H8ClN3S MolecularWeight: 189.66582

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NC=NN1)Cl

Isomeric SMILES

C/C(=C\CSC1=NC=NN1)/Cl

InChI

InChI=1S/C6H8ClN3S/c1-5(7)2-3-11-6-8-4-9-10-6/h2,4H,3H2,1H3,(H,8,9,10)/b5-2+