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A1A50

Summary
Name:7-methyl-N-[6-(methylamino)pyridin-3-yl]-1-benzothiophene-2-sulfonamide
Formula:C15 H15 N3 O2 S2
Formal charge:0
Formula weight:333.429 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.527-methyl-N-[6-(methylamino)pyridin-3-yl]-1-benzothiophene-2-sulfonamide
OpenEye OEToolkits3.1.0.07-methyl-~{N}-[6-(methylamino)pyridin-3-yl]-1-benzothiophene-2-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52CNc1ccc(cn1)NS(=O)(=O)c1cc2cccc(C)c2s1
InChIInChI1.06InChI=1S/C15H15N3O2S2/c1-10-4-3-5-11-8-14(21-15(10)11)22(19,20)18-12-6-7-13(16-2)17-9-12/h3-9,18H,1-2H3,(H,16,17)
InChIKeyInChI1.06YGNNZSHHLLSWRD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CNc1ccc(N[S](=O)(=O)c2sc3c(C)cccc3c2)cn1
SMILESCACTVS3.385CNc1ccc(N[S](=O)(=O)c2sc3c(C)cccc3c2)cn1
SMILES_CANONICALOpenEye OEToolkits3.1.0.0Cc1cccc2c1sc(c2)S(=O)(=O)Nc3ccc(nc3)NC
SMILESOpenEye OEToolkits3.1.0.0Cc1cccc2c1sc(c2)S(=O)(=O)Nc3ccc(nc3)NC

250835

PDB entries from 2026-03-18

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