2-chloranyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-(4-fluorophenyl)sulfanylpropyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[3-[(4-fluorophenyl)thio]propyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[3-(4-fluorophenyl)sulfanylpropyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-[(4-fluorophenyl)thio]propyl]-5-piperidinosulfonyl-benzamide Formula: C21H24ClFN2O3S2 MolecularWeight: 471.008263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClFN2O3S2/c22-20-10-9-18(30(27,28)25-12-2-1-3-13-25)15-19(20)21(26)24-11-4-14-29-17-7-5-16(23)6-8-17/h5-10,15H,1-4,11-14H2,(H,24,26)