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JLY

Summary
Name:4-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridine
Formula:C14 H13 N O S
Formal charge:0
Formula weight:243.324 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridine
OpenEye OEToolkits2.0.64-(4-methoxyphenyl)-6,7-dihydrothieno[3,2-c]pyridine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c23c(C(c1ccc(OC)cc1)=NCC2)ccs3
InChIInChI1.03InChI=1S/C14H13NOS/c1-16-11-4-2-10(3-5-11)14-12-7-9-17-13(12)6-8-15-14/h2-5,7,9H,6,8H2,1H3
InChIKeyInChI1.03BYZQPJHAZYJXRH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(cc1)C2=NCCc3sccc23
SMILESCACTVS3.385COc1ccc(cc1)C2=NCCc3sccc23
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1ccc(cc1)C2=NCCc3c2ccs3
SMILESOpenEye OEToolkits2.0.6COc1ccc(cc1)C2=NCCc3c2ccs3

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PDB entries from 2024-03-27

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