3-phenacylthian-4-one

Systemtic Name: 3-phenacylthian-4-one Openeye Name: 3-phenacyltetrahydrothiopyran-4-one CAS Name: 3-phenacyl-4-thianone IUPAC Name: 3-phenacylthian-4-one Traditional Name: 3-phenacyltetrahydrothiopyran-4-one Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(C1=O)CC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CSCC(C1=O)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14O2S/c14-12-6-7-16-9-11(12)8-13(15)10-4-2-1-3-5-10/h1-5,11H,6-9H2