N-[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(4R)-8-fluorothiochroman-4-yl]-4-morpholinosulfonyl-benzamide CAS Name: N-[(4R)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(4R)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(4R)-8-fluorothiochroman-4-yl]-4-morpholinosulfonyl-benzamide Formula: C20H21FN2O4S2 MolecularWeight: 436.520143

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C=CC=C2F

Isomeric SMILES

C1CSC2=C([C@@H]1NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C=CC=C2F

InChI

InChI=1S/C20H21FN2O4S2/c21-17-3-1-2-16-18(8-13-28-19(16)17)22-20(24)14-4-6-15(7-5-14)29(25,26)23-9-11-27-12-10-23/h1-7,18H,8-13H2,(H,22,24)/t18-/m1/s1