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Summary Geometry Related PDB entries

XHC

Summary

Name:	(5S)-3-({4-chloro-3-[(4-chlorophenyl)methyl]phenyl}methyl)-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
Formula:	C25 H22 Cl2 N2 O2
Formal charge:	0
Formula weight:	453.36 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	(5S)-3-({4-chloro-3-[(4-chlorophenyl)methyl]phenyl}methyl)-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
OpenEye OEToolkits	2.0.7	(5~{S})-3-[[4-chloranyl-3-[(4-chlorophenyl)methyl]phenyl]methyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Clc1ccc(cc1)Cc1cc(CN2C(=O)C(C)(NC2=O)c2ccc(C)cc2)ccc1Cl
InChI	InChI	1.06	InChI=1S/C25H22Cl2N2O2/c1-16-3-8-20(9-4-16)25(2)23(30)29(24(31)28-25)15-18-7-12-22(27)19(14-18)13-17-5-10-21(26)11-6-17/h3-12,14H,13,15H2,1-2H3,(H,28,31)/t25-/m0/s1
InChIKey	InChI	1.06	DQRPBPYBCXLUNW-VWLOTQADSA-N
SMILES_CANONICAL	CACTVS	3.385	Cc1ccc(cc1)[C@]2(C)NC(=O)N(Cc3ccc(Cl)c(Cc4ccc(Cl)cc4)c3)C2=O
SMILES	CACTVS	3.385	Cc1ccc(cc1)[C]2(C)NC(=O)N(Cc3ccc(Cl)c(Cc4ccc(Cl)cc4)c3)C2=O
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	Cc1ccc(cc1)[C@]2(C(=O)N(C(=O)N2)Cc3ccc(c(c3)Cc4ccc(cc4)Cl)Cl)C
SMILES	OpenEye OEToolkits	2.0.7	Cc1ccc(cc1)C2(C(=O)N(C(=O)N2)Cc3ccc(c(c3)Cc4ccc(cc4)Cl)Cl)C

248636

PDB entries from 2026-02-04

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