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A1AUL

Summary
Name:2-(2-chloroethoxy)-N-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoyl]benzene-1-sulfonamide
Formula:C15 H17 Cl N4 O5 S
Formal charge:0
Formula weight:400.837 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-(2-chloroethoxy)-N-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoyl]benzene-1-sulfonamide
OpenEye OEToolkits2.0.71-[2-(2-chloroethyloxy)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(Nc1nc(C)cc(OC)n1)NS(=O)(=O)c1ccccc1OCCCl
InChIInChI1.06InChI=1S/C15H17ClN4O5S/c1-10-9-13(24-2)18-14(17-10)19-15(21)20-26(22,23)12-6-4-3-5-11(12)25-8-7-16/h3-6,9H,7-8H2,1-2H3,(H2,17,18,19,20,21)
InChIKeyInChI1.06GNORLOQNBSLCCS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(C)nc(NC(=O)N[S](=O)(=O)c2ccccc2OCCCl)n1
SMILESCACTVS3.385COc1cc(C)nc(NC(=O)N[S](=O)(=O)c2ccccc2OCCCl)n1
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cc(nc(n1)NC(=O)NS(=O)(=O)c2ccccc2OCCCl)OC
SMILESOpenEye OEToolkits2.0.7Cc1cc(nc(n1)NC(=O)NS(=O)(=O)c2ccccc2OCCCl)OC

247947

PDB entries from 2026-01-21

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