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SL9

Summary
Name:(2~{S})-2-acetamido-6-(2-sulfanylethanimidoylamino)hexanamide
Formula:C10 H20 N4 O2 S
Formal charge:0
Formula weight:260.356 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S})-2-acetamido-6-(2-sulfanylethanimidoylamino)hexanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C10H20N4O2S/c1-7(15)14-8(10(12)16)4-2-3-5-13-9(11)6-17/h8,17H,2-6H2,1H3,(H2,11,13)(H2,12,16)(H,14,15)/t8-/m0/s1
InChIKeyInChI1.06VZQPDVWZAWZPHB-QMMMGPOBSA-N
SMILES_CANONICALCACTVS3.385CC(=O)N[C@@H](CCCCNC(=N)CS)C(N)=O
SMILESCACTVS3.385CC(=O)N[CH](CCCCNC(=N)CS)C(N)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7[H]/N=C(/CS)\NCCCC[C@@H](C(=O)N)NC(=O)C
SMILESOpenEye OEToolkits2.0.7CC(=O)NC(CCCCNC(=N)CS)C(=O)N

222926

PDB entries from 2024-07-24

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