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GCZ

Summary
Name:N-[(3aR,6aS)-hexahydrocyclopenta[c]pyrrol-2(1H)-ylcarbamoyl]-4-methylbenzenesulfonamide
Synonyms:gliclazide
Formula:C15 H21 N3 O3 S
Formal charge:0
Formula weight:323.411 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-[(3aR,6aS)-hexahydrocyclopenta[c]pyrrol-2(1H)-ylcarbamoyl]-4-methylbenzenesulfonamide
OpenEye OEToolkits1.9.21-[(3aR,6aS)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-3-(4-methylphenyl)sulfonyl-urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(NN2CC1CCCC1C2)NS(=O)(=O)c3ccc(cc3)C
InChIInChI1.03InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)/t12-,13+
InChIKeyInChI1.03BOVGTQGAOIONJV-BETUJISGSA-N
SMILES_CANONICALCACTVS3.385Cc1ccc(cc1)[S](=O)(=O)NC(=O)NN2C[C@H]3CCC[C@H]3C2
SMILESCACTVS3.385Cc1ccc(cc1)[S](=O)(=O)NC(=O)NN2C[CH]3CCC[CH]3C2
SMILES_CANONICALOpenEye OEToolkits1.9.2Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2C[C@H]3CCC[C@H]3C2
SMILESOpenEye OEToolkits1.9.2Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2

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건을2024-08-07부터공개중

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