4-fluoranyl-N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-(3-phenylsulfanylpropyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-[3-(phenylthio)propyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[3-(phenylthio)propyl]-3-piperidinosulfonyl-benzamide Formula: C21H25FN2O3S2 MolecularWeight: 436.563203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCSC3=CC=CC=C3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCSC3=CC=CC=C3)F

InChI

InChI=1S/C21H25FN2O3S2/c22-19-11-10-17(16-20(19)29(26,27)24-13-5-2-6-14-24)21(25)23-12-7-15-28-18-8-3-1-4-9-18/h1,3-4,8-11,16H,2,5-7,12-15H2,(H,23,25)