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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22Cl2N6O4
Molecular Weight 481.332
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea

SMILES

ClCCN(N=O)C(=O)NCC1=CC=C(C=C1)C2=CC=C(CNC(=O)N(CCCl)N=O)C=C2

InChI

InChIKey=WBBBFCSVHULAOX-UHFFFAOYSA-N
InChI=1S/C20H22Cl2N6O4/c21-9-11-27(25-31)19(29)23-13-15-1-5-17(6-2-15)18-7-3-16(4-8-18)14-24-20(30)28(26-32)12-10-22/h1-8H,9-14H2,(H,23,29)(H,24,30)

HIDE SMILES / InChI

Approval Year

Name Type Language
1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea
Systematic Name English
NSC-116821
Preferred Name English
Urea, N,N??-[[1,1?-biphenyl]-4,4?-diylbis(methylene)]bis[N?-(2-chloroethyl)-N?-nitroso-
Common Name English
Code System Code Type Description
PUBCHEM
97348
Created by admin on Tue Apr 01 19:35:35 GMT 2025 , Edited by admin on Tue Apr 01 19:35:35 GMT 2025
PRIMARY
FDA UNII
Y3XFP4J4QJ
Created by admin on Tue Apr 01 19:35:35 GMT 2025 , Edited by admin on Tue Apr 01 19:35:35 GMT 2025
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NSC
116821
Created by admin on Tue Apr 01 19:35:35 GMT 2025 , Edited by admin on Tue Apr 01 19:35:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID70202716
Created by admin on Tue Apr 01 19:35:35 GMT 2025 , Edited by admin on Tue Apr 01 19:35:35 GMT 2025
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CAS
54340-56-6
Created by admin on Tue Apr 01 19:35:35 GMT 2025 , Edited by admin on Tue Apr 01 19:35:35 GMT 2025
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