3-[bis(fluoranyl)methoxy]-2-cyano-N-methyl-benzenesulfonamide; methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate

Systemtic Name: 3-[bis(fluoranyl)methoxy]-2-cyano-N-methyl-benzenesulfonamide; methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate Openeye Name: 2-cyano-3-(difluoromethoxy)-N-methyl-benzenesulfonamide; methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate CAS Name: N-[1-[butylamino(oxo)methyl]-2-benzimidazolyl]carbamic acid methyl ester; 2-cyano-3-(difluoromethoxy)-N-methylbenzenesulfonamide IUPAC Name: 2-cyano-3-(difluoromethoxy)-N-methylbenzenesulfonamide; methyl N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamate Traditional Name: N-[1-(butylcarbamoyl)benzimidazol-2-yl]carbamic acid methyl ester; 2-cyano-3-(difluoromethoxy)-N-methyl-benzenesulfonamide Formula: C23H26F2N6O6S MolecularWeight: 552.550946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1C2=CC=CC=C2N=C1NC(=O)OC.CNS(=O)(=O)C1=CC=CC(=C1C#N)OC(F)F

Isomeric SMILES

CCCCNC(=O)N1C2=CC=CC=C2N=C1NC(=O)OC.CNS(=O)(=O)C1=CC=CC(=C1C#N)OC(F)F

InChI

InChI=1S/C14H18N4O3.C9H8F2N2O3S/c1-3-4-9-15-13(19)18-11-8-6-5-7-10(11)16-12(18)17-14(20)21-2;1-13-17(14,15)8-4-2-3-7(6(8)5-12)16-9(10)11/h5-8H,3-4,9H2,1-2H3,(H,15,19)(H,16,17,20);2-4,9,13H,1H3