96D

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Summary

Name:N-[(5-cyanopyrazin-2-yl)carbamoyl]-3-(difluoromethoxy)benzene-1-sulfonamide
Formula:C13 H9 F2 N5 O4 S
Formal charge:0
Molecular weight:369.303 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[(5-cyanopyrazin-2-yl)carbamoyl]-3-(difluoromethoxy)benzene-1-sulfonamide
OpenEye OEToolkits2.0.61-[3-[bis(fluoranyl)methoxy]phenyl]sulfonyl-3-(5-cyanopyrazin-2-yl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N(C(Nc1cnc(C#N)cn1)=O)S(c2cc(ccc2)OC(F)F)(=O)=O
InChIInChI1.03InChI=1S/C13H9F2N5O4S/c14-12(15)24-9-2-1-3-10(4-9)25(22,23)20-13(21)19-11-7-17-8(5-16)6-18-11/h1-4,6-7,12H,(H2,18,19,20,21)
InChIKeyInChI1.03OWMYCUOZBLTFPG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385FC(F)Oc1cccc(c1)[S](=O)(=O)NC(=O)Nc2cnc(cn2)C#N
SMILESCACTVS3.385FC(F)Oc1cccc(c1)[S](=O)(=O)NC(=O)Nc2cnc(cn2)C#N
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(cc(c1)S(=O)(=O)NC(=O)Nc2cnc(cn2)C#N)OC(F)F
SMILESOpenEye OEToolkits2.0.6c1cc(cc(c1)S(=O)(=O)NC(=O)Nc2cnc(cn2)C#N)OC(F)F
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