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468

Summary
Name:(3S)-N-(3-CHLORO-2-METHYLPHENYL)-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE
Formula:C18 H23 Cl N2 O2
Formal charge:0
Formula weight:334.84 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(3S)-N-(3-chloro-2-methylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
OpenEye OEToolkits1.5.0(3S)-N-(3-chloro-2-methyl-phenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc1cccc(c1C)NC(=O)C3CC(=O)N(C2CCCCC2)C3
SMILES_CANONICALCACTVS3.341Cc1c(Cl)cccc1NC(=O)[C@@H]2CN(C3CCCCC3)C(=O)C2
SMILESCACTVS3.341Cc1c(Cl)cccc1NC(=O)[CH]2CN(C3CCCCC3)C(=O)C2
SMILES_CANONICALOpenEye OEToolkits1.5.0Cc1c(cccc1Cl)NC(=O)[C@H]2CC(=O)N(C2)C3CCCCC3
SMILESOpenEye OEToolkits1.5.0Cc1c(cccc1Cl)NC(=O)C2CC(=O)N(C2)C3CCCCC3
InChIInChI1.03InChI=1S/C18H23ClN2O2/c1-12-15(19)8-5-9-16(12)20-18(23)13-10-17(22)21(11-13)14-6-3-2-4-7-14/h5,8-9,13-14H,2-4,6-7,10-11H2,1H3,(H,20,23)/t13-/m0/s1
InChIKeyInChI1.03NJNMAZNXKKBTPS-ZDUSSCGKSA-N

248636

PDB entries from 2026-02-04

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