(4S)-3-(3-methoxypropanoyl)-7,7-dimethyl-4-pyridin-4-yl-6,8-dihydro-4H-thiochromen-5-one

Systemtic Name: (4S)-3-(3-methoxypropanoyl)-7,7-dimethyl-4-pyridin-4-yl-6,8-dihydro-4H-thiochromen-5-one Openeye Name: (4S)-3-(3-methoxypropanoyl)-7,7-dimethyl-4-(4-pyridyl)-6,8-dihydro-4H-thiochromen-5-one CAS Name: (4S)-3-(3-methoxy-1-oxopropyl)-7,7-dimethyl-4-pyridin-4-yl-6,8-dihydro-4H-1-benzothiopyran-5-one IUPAC Name: (4S)-3-(3-methoxypropanoyl)-7,7-dimethyl-4-pyridin-4-yl-6,8-dihydro-4H-thiochromen-5-one Traditional Name: (4S)-3-(3-methoxypropanoyl)-7,7-dimethyl-4-(4-pyridyl)-6,8-dihydro-4H-thiochromen-5-one Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=CS2)C(=O)CCOC)C3=CC=NC=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H](C(=CS2)C(=O)CCOC)C3=CC=NC=C3)C(=O)C1)C

InChI

InChI=1S/C20H23NO3S/c1-20(2)10-16(23)19-17(11-20)25-12-14(15(22)6-9-24-3)18(19)13-4-7-21-8-5-13/h4-5,7-8,12,18H,6,9-11H2,1-3H3/t18-/m0/s1