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EB3

Summary
Name:N-cyclohexyl-1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide
Formula:C19 H22 N2 O3 S
Formal charge:0
Formula weight:358.455 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-cyclohexyl-1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide
OpenEye OEToolkits1.9.2N-cyclohexyl-1-ethyl-2-oxidanylidene-benzo[cd]indole-6-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C1C(CCCC1)NS(=O)(c3ccc2N(C(c4c2c3ccc4)=O)CC)=O
InChIInChI1.03InChI=1S/C19H22N2O3S/c1-2-21-16-11-12-17(14-9-6-10-15(18(14)16)19(21)22)25(23,24)20-13-7-4-3-5-8-13/h6,9-13,20H,2-5,7-8H2,1H3
InChIKeyInChI1.03JFSBLFHOLQSPDO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCN1C(=O)c2cccc3c(ccc1c23)[S](=O)(=O)NC4CCCCC4
SMILESCACTVS3.385CCN1C(=O)c2cccc3c(ccc1c23)[S](=O)(=O)NC4CCCCC4
SMILES_CANONICALOpenEye OEToolkits1.9.2CCN1c2ccc(c3c2c(ccc3)C1=O)S(=O)(=O)NC4CCCCC4
SMILESOpenEye OEToolkits1.9.2CCN1c2ccc(c3c2c(ccc3)C1=O)S(=O)(=O)NC4CCCCC4

224201

数据于2024-08-28公开中

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