1-(4-bromophenyl)sulfonyl-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)pyrrolidine-2-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-(6-fluorothiochroman-4-yl)pyrrolidine-2-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)pyrrolidine-2-carboxamide Traditional Name: 1-brosyl-N-(6-fluorothiochroman-4-yl)pyrrolidine-2-carboxamide Formula: C20H20BrFN2O3S2 MolecularWeight: 499.416803

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NC3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C20H20BrFN2O3S2/c21-13-3-6-15(7-4-13)29(26,27)24-10-1-2-18(24)20(25)23-17-9-11-28-19-8-5-14(22)12-16(17)19/h3-8,12,17-18H,1-2,9-11H2,(H,23,25)