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

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)piperidine-3-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-(6-fluorothiochroman-4-yl)piperidine-3-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)piperidine-3-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-(6-fluorothiochroman-4-yl)nipecotamide Formula: C21H22ClFN2O3S2 MolecularWeight: 468.992383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NC3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H22ClFN2O3S2/c22-15-3-6-17(7-4-15)30(27,28)25-10-1-2-14(13-25)21(26)24-19-9-11-29-20-8-5-16(23)12-18(19)20/h3-8,12,14,19H,1-2,9-11,13H2,(H,24,26)