Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

ENU

Summary
Name:6-cyclohexyloxy-9-ethyl-~{N}-[(4-ethylsulfonylphenyl)methyl]carbazole-3-carboxamide
Formula:C30 H34 N2 O4 S
Formal charge:0
Formula weight:518.667 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-cyclohexyloxy-9-ethyl-~{N}-[(4-ethylsulfonylphenyl)methyl]carbazole-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C30H34N2O4S/c1-3-32-28-16-12-22(30(33)31-20-21-10-14-25(15-11-21)37(34,35)4-2)18-26(28)27-19-24(13-17-29(27)32)36-23-8-6-5-7-9-23/h10-19,23H,3-9,20H2,1-2H3,(H,31,33)
InChIKeyInChI1.03XJCREIMPADNIDU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCn1c2ccc(OC3CCCCC3)cc2c4cc(ccc14)C(=O)NCc5ccc(cc5)[S](=O)(=O)CC
SMILESCACTVS3.385CCn1c2ccc(OC3CCCCC3)cc2c4cc(ccc14)C(=O)NCc5ccc(cc5)[S](=O)(=O)CC
SMILES_CANONICALOpenEye OEToolkits2.0.7CCn1c2ccc(cc2c3c1ccc(c3)OC4CCCCC4)C(=O)NCc5ccc(cc5)S(=O)(=O)CC
SMILESOpenEye OEToolkits2.0.7CCn1c2ccc(cc2c3c1ccc(c3)OC4CCCCC4)C(=O)NCc5ccc(cc5)S(=O)(=O)CC

222624

PDB entries from 2024-07-17

PDB statisticsPDBj update infoContact PDBjnumon