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BNK

Summary
Name:2-chloro-N-cyclopentyl-5-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide
Formula:C14 H15 Cl N2 O3 S2
Formal charge:0
Formula weight:358.864 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-chloro-N-cyclopentyl-5-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide
OpenEye OEToolkits1.7.62-chloranyl-N-cyclopentyl-5-(2-oxidanylidene-3H-1,3-thiazol-4-yl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C3SC=C(c1cc(c(Cl)cc1)S(=O)(=O)NC2CCCC2)N3
InChIInChI1.03InChI=1S/C14H15ClN2O3S2/c15-11-6-5-9(12-8-21-14(18)16-12)7-13(11)22(19,20)17-10-3-1-2-4-10/h5-8,10,17H,1-4H2,(H,16,18)
InChIKeyInChI1.03PBWTZCXFWIEPCV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1ccc(cc1[S](=O)(=O)NC2CCCC2)C3=CSC(=O)N3
SMILESCACTVS3.385Clc1ccc(cc1[S](=O)(=O)NC2CCCC2)C3=CSC(=O)N3
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(c(cc1C2=CSC(=O)N2)S(=O)(=O)NC3CCCC3)Cl
SMILESOpenEye OEToolkits1.7.6c1cc(c(cc1C2=CSC(=O)N2)S(=O)(=O)NC3CCCC3)Cl

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PDB entries from 2024-07-10

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