1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-1-one

Systemtic Name: 1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-1-one Openeye Name: 1-(2-methylthiochroman-6-yl)propan-1-one CAS Name: 1-(2-methyl-3,4-dihydro-2H-1-benzothiopyran-6-yl)-1-propanone IUPAC Name: 1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-1-one Traditional Name: 1-(2-methylthiochroman-6-yl)propan-1-one Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)SC(CC2)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)SC(CC2)C

InChI

InChI=1S/C13H16OS/c1-3-12(14)10-6-7-13-11(8-10)5-4-9(2)15-13/h6-9H,3-5H2,1-2H3