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

Systemtic Name: 4-fluoranyl-N-(4-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-(4-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-fluoro-N-[4-(methylthio)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-(4-methylsulfanylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[4-(methylthio)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C18H19FN2O3S2 MolecularWeight: 394.483463

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H19FN2O3S2/c1-25-15-7-5-14(6-8-15)20-18(22)13-4-9-16(19)17(12-13)26(23,24)21-10-2-3-11-21/h4-9,12H,2-3,10-11H2,1H3,(H,20,22)