4-fluoranyl-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]carbamothioyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]carbamothioyl]benzamide Openeye Name: 4-fluoro-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]carbamothioyl]benzamide CAS Name: 4-fluoro-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-fluoro-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-ylphenyl]carbamothioyl]benzamide Traditional Name: 4-fluoro-N-[[3-[(2-methoxyphenyl)sulfamoyl]-4-pyrrolidino-phenyl]thiocarbamoyl]benzamide Formula: C25H25FN4O4S2 MolecularWeight: 528.618803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)N4CCCC4

InChI

InChI=1S/C25H25FN4O4S2/c1-34-22-7-3-2-6-20(22)29-36(32,33)23-16-19(12-13-21(23)30-14-4-5-15-30)27-25(35)28-24(31)17-8-10-18(26)11-9-17/h2-3,6-13,16,29H,4-5,14-15H2,1H3,(H2,27,28,31,35)