N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(4S)-6-fluorothiochroman-4-yl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(4S)-6-fluorothiochroman-4-yl]-3,4,5-trimethoxy-benzamide Formula: C19H20FNO4S MolecularWeight: 377.429803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N[C@H]2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C19H20FNO4S/c1-23-15-8-11(9-16(24-2)18(15)25-3)19(22)21-14-6-7-26-17-5-4-12(20)10-13(14)17/h4-5,8-10,14H,6-7H2,1-3H3,(H,21,22)/t14-/m0/s1