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SY0

Summary
Name:(2~{S})-2-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-1-yl]ethanoylamino]-~{N}-ethyl-propanamide
Formula:C15 H21 N5 O3
Formal charge:0
Formula weight:319.359 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S})-2-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-1-yl]ethanoylamino]-~{N}-ethyl-propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C15H21N5O3/c1-5-16-15(22)10(3)18-13(21)8-20-7-12(6-17-20)14-9(2)19-23-11(14)4/h6-7,10H,5,8H2,1-4H3,(H,16,22)(H,18,21)/t10-/m0/s1
InChIKeyInChI1.06UJPHDNXNLWIDIQ-JTQLQIEISA-N
SMILES_CANONICALCACTVS3.385CCNC(=O)[C@H](C)NC(=O)Cn1cc(cn1)c2c(C)onc2C
SMILESCACTVS3.385CCNC(=O)[CH](C)NC(=O)Cn1cc(cn1)c2c(C)onc2C
SMILES_CANONICALOpenEye OEToolkits2.0.7CCNC(=O)[C@H](C)NC(=O)Cn1cc(cn1)c2c(noc2C)C
SMILESOpenEye OEToolkits2.0.7CCNC(=O)C(C)NC(=O)Cn1cc(cn1)c2c(noc2C)C

227344

数据于2024-11-13公开中

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