3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene

Systemtic Name: 3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Openeye Name: 3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 3-hexyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Formula: C12H16S MolecularWeight: 192.32044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=C1)S2

Isomeric SMILES

CCCCCCC1=C2C=CC(=C1)S2

InChI

InChI=1S/C12H16S/c1-2-3-4-5-6-10-9-11-7-8-12(10)13-11/h7-9H,2-6H2,1H3