3-[[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C18H15ClFN3O4S2 MolecularWeight: 455.910803

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C18H15ClFN3O4S2/c1-23(2)29(26,27)12-5-3-4-10(8-12)17(24)21-22-18(25)16-15(19)13-7-6-11(20)9-14(13)28-16/h3-9H,1-2H3,(H,21,24)(H,22,25)