N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: N-(6-fluorothiochroman-4-yl)-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: N-(6-fluorothiochroman-4-yl)-2-(4-methoxy-3-morpholinosulfonyl-phenyl)acetamide Formula: C22H25FN2O5S2 MolecularWeight: 480.572703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2CCSC3=C2C=C(C=C3)F)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2CCSC3=C2C=C(C=C3)F)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25FN2O5S2/c1-29-19-4-2-15(12-21(19)32(27,28)25-7-9-30-10-8-25)13-22(26)24-18-6-11-31-20-5-3-16(23)14-17(18)20/h2-5,12,14,18H,6-11,13H2,1H3,(H,24,26)