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

OA2

Summary
Name:2-AMINO-N,N-BIS(PHENYLMETHYL)-1,3-OXAZOLE-5-CARBOXAMIDE
Formula:C18 H17 N3 O2
Formal charge:0
Formula weight:307.346 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-amino-N,N-dibenzyl-1,3-oxazole-5-carboxamide
OpenEye OEToolkits1.6.12-amino-N,N-bis(phenylmethyl)-1,3-oxazole-5-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(N(Cc1ccccc1)Cc2ccccc2)c3oc(nc3)N
SMILES_CANONICALCACTVS3.352Nc1oc(cn1)C(=O)N(Cc2ccccc2)Cc3ccccc3
SMILESCACTVS3.352Nc1oc(cn1)C(=O)N(Cc2ccccc2)Cc3ccccc3
SMILES_CANONICALOpenEye OEToolkits1.6.1c1ccc(cc1)CN(Cc2ccccc2)C(=O)c3cnc(o3)N
SMILESOpenEye OEToolkits1.6.1c1ccc(cc1)CN(Cc2ccccc2)C(=O)c3cnc(o3)N
InChIInChI1.03InChI=1S/C18H17N3O2/c19-18-20-11-16(23-18)17(22)21(12-14-7-3-1-4-8-14)13-15-9-5-2-6-10-15/h1-11H,12-13H2,(H2,19,20)
InChIKeyInChI1.03KIJXWOGFYAWTNC-UHFFFAOYSA-N

223532

数据于2024-08-07公开中

PDB statisticsPDBj update infoContact PDBjnumon