Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

A1BKZ

Summary
Name:N-[3-(methanesulfonamido)phenyl]-4-phenylthiophene-2-carboxamide
Formula:C18 H16 N2 O3 S2
Formal charge:0
Formula weight:372.461 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52N-[3-(methanesulfonamido)phenyl]-4-phenylthiophene-2-carboxamide
OpenEye OEToolkits3.1.0.0~{N}-[3-(methylsulfonylamino)phenyl]-4-phenyl-thiophene-2-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52CS(=O)(=O)Nc1cccc(c1)NC(=O)c1cc(cs1)c1ccccc1
InChIInChI1.06InChI=1S/C18H16N2O3S2/c1-25(22,23)20-16-9-5-8-15(11-16)19-18(21)17-10-14(12-24-17)13-6-3-2-4-7-13/h2-12,20H,1H3,(H,19,21)
InChIKeyInChI1.06GMWBWXRCKWTKAO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385C[S](=O)(=O)Nc1cccc(NC(=O)c2scc(c2)c3ccccc3)c1
SMILESCACTVS3.385C[S](=O)(=O)Nc1cccc(NC(=O)c2scc(c2)c3ccccc3)c1
SMILES_CANONICALOpenEye OEToolkits3.1.0.0CS(=O)(=O)Nc1cccc(c1)NC(=O)c2cc(cs2)c3ccccc3
SMILESOpenEye OEToolkits3.1.0.0CS(=O)(=O)Nc1cccc(c1)NC(=O)c2cc(cs2)c3ccccc3

249697

PDB entries from 2026-02-25

PDB statisticsPDBj update infoContact PDBjnumon