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

Systemtic Name: 1-(3,4-dihydro-2H-thiochromen-6-yl)-3-(1-ethanoylpiperidin-4-yl)propan-1-one Openeye Name: 3-(1-acetyl-4-piperidyl)-1-thiochroman-6-yl-propan-1-one CAS Name: 3-(1-acetyl-4-piperidinyl)-1-(3,4-dihydro-2H-1-benzothiopyran-6-yl)-1-propanone IUPAC Name: 3-(1-acetylpiperidin-4-yl)-1-(3,4-dihydro-2H-thiochromen-6-yl)propan-1-one Traditional Name: 3-(1-acetyl-4-piperidyl)-1-thiochroman-6-yl-propan-1-one Formula: C19H25NO2S MolecularWeight: 331.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)CCC(=O)C2=CC3=C(C=C2)SCCC3

Isomeric SMILES

CC(=O)N1CCC(CC1)CCC(=O)C2=CC3=C(C=C2)SCCC3

InChI

InChI=1S/C19H25NO2S/c1-14(21)20-10-8-15(9-11-20)4-6-18(22)16-5-7-19-17(13-16)3-2-12-23-19/h5,7,13,15H,2-4,6,8-12H2,1H3