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8EA

Summary
Name:N-(2-{[(4-chlorophenyl)methyl]disulfanyl}ethyl)decan-1-amine
Formula:C19 H32 Cl N S2
Formal charge:0
Formula weight:374.047 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-(2-{[(4-chlorophenyl)methyl]disulfanyl}ethyl)decan-1-amine
OpenEye OEToolkits2.0.6~{N}-[2-[(4-chlorophenyl)methyldisulfanyl]ethyl]decan-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(CCCCCCCC)CNCCSSCc1ccc(cc1)Cl
InChIInChI1.03InChI=1S/C19H32ClNS2/c1-2-3-4-5-6-7-8-9-14-21-15-16-22-23-17-18-10-12-19(20)13-11-18/h10-13,21H,2-9,14-17H2,1H3
InChIKeyInChI1.03MTCITSZEZJBERN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCCCNCCSSCc1ccc(Cl)cc1
SMILESCACTVS3.385CCCCCCCCCCNCCSSCc1ccc(Cl)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6CCCCCCCCCCNCCSSCc1ccc(cc1)Cl
SMILESOpenEye OEToolkits2.0.6CCCCCCCCCCNCCSSCc1ccc(cc1)Cl

226707

數據於2024-10-30公開中

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