1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone

Systemtic Name: 1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone Openeye Name: 1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone CAS Name: 1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone IUPAC Name: 1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone Traditional Name: 1-(2,3,4,5-tetrahydrothiepin-6-yl)ethanone Formula: C8H12OS MolecularWeight: 156.24528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CSCCCC1

Isomeric SMILES

CC(=O)C1=CSCCCC1

InChI

InChI=1S/C8H12OS/c1-7(9)8-4-2-3-5-10-6-8/h6H,2-5H2,1H3