2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[[2-(4-fluorophenyl)thiazol-4-yl]methoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[[2-(4-fluorophenyl)-4-thiazolyl]methoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[[2-(4-fluorophenyl)thiazol-4-yl]methoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C21H20FN3O4S2 MolecularWeight: 461.529603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CSC(=N3)C4=CC=C(C=C4)F)C(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CSC(=N3)C4=CC=C(C=C4)F)C(=O)N

InChI

InChI=1S/C21H20FN3O4S2/c22-15-5-3-14(4-6-15)21-24-16(13-30-21)12-29-19-8-7-17(11-18(19)20(23)26)31(27,28)25-9-1-2-10-25/h3-8,11,13H,1-2,9-10,12H2,(H2,23,26)