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

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(2-fluorophenyl)sulfonyl-N-(6-fluorothiochroman-4-yl)piperidine-4-carboxamide CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N-(6-fluorothiochroman-4-yl)isonipecotamide Formula: C21H22F2N2O3S2 MolecularWeight: 452.537786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2CCSC3=C2C=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCC1C(=O)NC2CCSC3=C2C=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C21H22F2N2O3S2/c22-15-5-6-19-16(13-15)18(9-12-29-19)24-21(26)14-7-10-25(11-8-14)30(27,28)20-4-2-1-3-17(20)23/h1-6,13-14,18H,7-12H2,(H,24,26)