N-[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(4R)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(4R)-8-fluorothiochroman-4-yl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[(4R)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(4R)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(4R)-8-fluorothiochroman-4-yl]-4-piperidinosulfonyl-benzamide Formula: C21H23FN2O3S2 MolecularWeight: 434.547323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3CCSC4=C3C=CC=C4F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N[C@@H]3CCSC4=C3C=CC=C4F

InChI

InChI=1S/C21H23FN2O3S2/c22-18-6-4-5-17-19(11-14-28-20(17)18)23-21(25)15-7-9-16(10-8-15)29(26,27)24-12-2-1-3-13-24/h4-10,19H,1-3,11-14H2,(H,23,25)/t19-/m1/s1