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

Systemtic Name: 4-fluoranyl-N-(3-phenylsulfanylpropyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-(3-phenylsulfanylpropyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-fluoro-N-[3-(phenylthio)propyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-(3-phenylsulfanylpropyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[3-(phenylthio)propyl]-3-pyrrolidinosulfonyl-benzamide Formula: C20H23FN2O3S2 MolecularWeight: 422.536623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCSC3=CC=CC=C3)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCSC3=CC=CC=C3)F

InChI

InChI=1S/C20H23FN2O3S2/c21-18-10-9-16(15-19(18)28(25,26)23-12-4-5-13-23)20(24)22-11-6-14-27-17-7-2-1-3-8-17/h1-3,7-10,15H,4-6,11-14H2,(H,22,24)