3-[[2-(3-fluoranylphenoxy)ethanoylamino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: 3-[[2-(3-fluoranylphenoxy)ethanoylamino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 3-[[[2-(3-fluorophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: 3-[[[2-(3-fluorophenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-N,N-dimethyl-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 3-[[[2-(3-fluorophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 3-[[[2-(3-fluorophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidino-benzenesulfonamide Formula: C21H25FN4O5S MolecularWeight: 464.510403

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NNC(=O)COC3=CC(=CC=C3)F

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NNC(=O)COC3=CC(=CC=C3)F

InChI

InChI=1S/C21H25FN4O5S/c1-25(2)32(29,30)17-8-9-19(26-10-3-4-11-26)18(13-17)21(28)24-23-20(27)14-31-16-7-5-6-15(22)12-16/h5-9,12-13H,3-4,10-11,14H2,1-2H3,(H,23,27)(H,24,28)