3,3,6-trimethyl-4H-thiochromen-2-one

Systemtic Name: 3,3,6-trimethyl-4H-thiochromen-2-one Openeye Name: 3,3,6-trimethylthiochroman-2-one CAS Name: 3,3,6-trimethyl-4H-1-benzothiopyran-2-one IUPAC Name: 3,3,6-trimethyl-4H-thiochromen-2-one Traditional Name: 3,3,6-trimethylthiochroman-2-one Formula: C12H14OS MolecularWeight: 206.30396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=O)C(C2)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=O)C(C2)(C)C

InChI

InChI=1S/C12H14OS/c1-8-4-5-10-9(6-8)7-12(2,3)11(13)14-10/h4-6H,7H2,1-3H3