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OV4

Summary
Name:2-(1H-benzotriazol-1-yl)-N-benzyl-N-[4-(dimethylamino)phenyl]acetamide
Formula:C23 H23 N5 O
Formal charge:0
Formula weight:385.462 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-(1H-benzotriazol-1-yl)-N-benzyl-N-[4-(dimethylamino)phenyl]acetamide
OpenEye OEToolkits2.0.72-(benzotriazol-1-yl)-~{N}-[4-(dimethylamino)phenyl]-~{N}-(phenylmethyl)ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CN(C)c1ccc(cc1)N(Cc1ccccc1)C(=O)Cn1nnc2ccccc21
InChIInChI1.06InChI=1S/C23H23N5O/c1-26(2)19-12-14-20(15-13-19)27(16-18-8-4-3-5-9-18)23(29)17-28-22-11-7-6-10-21(22)24-25-28/h3-15H,16-17H2,1-2H3
InChIKeyInChI1.06KOZCSUYCMLWBNN-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CN(C)c1ccc(cc1)N(Cc2ccccc2)C(=O)Cn3nnc4ccccc34
SMILESCACTVS3.385CN(C)c1ccc(cc1)N(Cc2ccccc2)C(=O)Cn3nnc4ccccc34
SMILES_CANONICALOpenEye OEToolkits2.0.7CN(C)c1ccc(cc1)N(Cc2ccccc2)C(=O)Cn3c4ccccc4nn3
SMILESOpenEye OEToolkits2.0.7CN(C)c1ccc(cc1)N(Cc2ccccc2)C(=O)Cn3c4ccccc4nn3

218853

PDB entries from 2024-04-24

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