4-[(2E)-3,7-dimethylocta-2,6-dienyl]sulfanyl-2H-1,2,3-triazole

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]sulfanyl-2H-1,2,3-triazole Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]sulfanyl-2H-triazole CAS Name: 4-[[(2E)-3,7-dimethylocta-2,6-dienyl]thio]-2H-triazole IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienyl]sulfanyl-2H-triazole Traditional Name: 4-[[(2E)-3,7-dimethylocta-2,6-dienyl]thio]-2H-triazole Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCSC1=NNN=C1)C)C

Isomeric SMILES

CC(=CCC/C(=C/CSC1=NNN=C1)/C)C

InChI

InChI=1S/C12H19N3S/c1-10(2)5-4-6-11(3)7-8-16-12-9-13-15-14-12/h5,7,9H,4,6,8H2,1-3H3,(H,13,14,15)/b11-7+