95G

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Summary

Name:N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-[(3,4-dichloro-1-methyl-1H-pyrazol-5-yl)oxy]benzene-1-sulfonamide
Formula:C14 H10 Br Cl2 N5 O4 S2
Formal charge:0
Molecular weight:527.2 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]-4-[(3,4-dichloro-1-methyl-1H-pyrazol-5-yl)oxy]benzene-1-sulfonamide
OpenEye OEToolkits2.0.61-[4-[4,5-bis(chloranyl)-2-methyl-pyrazol-3-yl]oxyphenyl]sulfonyl-3-(5-bromanyl-1,3-thiazol-2-yl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c2(Oc1c(c(Cl)nn1C)Cl)ccc(cc2)S(NC(=O)Nc3sc(cn3)Br)(=O)=O
InChIInChI1.03InChI=1S/C14H10BrCl2N5O4S2/c1-22-12(10(16)11(17)20-22)26-7-2-4-8(5-3-7)28(24,25)21-13(23)19-14-18-6-9(15)27-14/h2-6H,1H3,(H2,18,19,21,23)
InChIKeyInChI1.03PRZBYMWCBKOTJZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cn1nc(Cl)c(Cl)c1Oc2ccc(cc2)[S](=O)(=O)NC(=O)Nc3sc(Br)cn3
SMILESCACTVS3.385Cn1nc(Cl)c(Cl)c1Oc2ccc(cc2)[S](=O)(=O)NC(=O)Nc3sc(Br)cn3
SMILES_CANONICALOpenEye OEToolkits2.0.6Cn1c(c(c(n1)Cl)Cl)Oc2ccc(cc2)S(=O)(=O)NC(=O)Nc3ncc(s3)Br
SMILESOpenEye OEToolkits2.0.6Cn1c(c(c(n1)Cl)Cl)Oc2ccc(cc2)S(=O)(=O)NC(=O)Nc3ncc(s3)Br
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