4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]carbamoyl]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]carbamoyl]-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]carbamoyl]-N-isopropyl-benzenesulfonamide CAS Name: 4-[[[3-[(4-fluorophenyl)thio]-1-oxopropyl]hydrazo]-oxomethyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]carbamoyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[[3-[(4-fluorophenyl)thio]propanoylamino]carbamoyl]-N-isopropyl-benzenesulfonamide Formula: C19H22FN3O4S2 MolecularWeight: 439.524083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C19H22FN3O4S2/c1-13(2)23-29(26,27)17-9-3-14(4-10-17)19(25)22-21-18(24)11-12-28-16-7-5-15(20)6-8-16/h3-10,13,23H,11-12H2,1-2H3,(H,21,24)(H,22,25)