2,2,5-trimethyl-7-sulfanyl-3H-chromen-4-one

Systemtic Name: 2,2,5-trimethyl-7-sulfanyl-3H-chromen-4-one Openeye Name: 2,2,5-trimethyl-7-sulfanyl-chroman-4-one CAS Name: 7-mercapto-2,2,5-trimethyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2,2,5-trimethyl-7-sulfanyl-3H-chromen-4-one Traditional Name: 7-mercapto-2,2,5-trimethyl-chroman-4-one Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)CC(O2)(C)C)S

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)CC(O2)(C)C)S

InChI

InChI=1S/C12H14O2S/c1-7-4-8(15)5-10-11(7)9(13)6-12(2,3)14-10/h4-5,15H,6H2,1-3H3