3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]propanamide

Systemtic Name: 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]propanamide Openeye Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(4S)-8-fluorothiochroman-4-yl]propanamide CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(4S)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]propanamide IUPAC Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[(4S)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]propanamide Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)-N-[(4S)-8-fluorothiochroman-4-yl]propionamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NC2CCSC3=C2C=CC=C3F)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)N[C@H]2CCSC3=C2C=CC=C3F)C)C#N

InChI

InChI=1S/C20H20FN3O2S/c1-11-13(12(2)23-20(26)15(11)10-22)6-7-18(25)24-17-8-9-27-19-14(17)4-3-5-16(19)21/h3-5,17H,6-9H2,1-2H3,(H,23,26)(H,24,25)/t17-/m0/s1