(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N′-bis(2-bromoethyl)phosphorodiamidate

CAS Registry Number®

918633-87-1

CAS Name

(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N′-bis(2-bromoethyl)phosphorodiamidate

Molecular Formula

C9H16Br2N5O4P

Molecular Mass

449.04

Cite this Page

(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N′-bis(2-bromoethyl)phosphorodiamidate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=918633-87-1 (retrieved 2024-11-22) (CAS RN: 918633-87-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H16Br2N5O4P/c1-15-8(6-12-9(15)16(17)18)7-20-21(19,13-4-2-10)14-5-3-11/h6H,2-5,7H2,1H3,(H2,13,14,19)

InChIKey

InChIKey=UGJWRPJDTDGERK-UHFFFAOYSA-N

SMILES

C(OP(NCCBr)(NCCBr)=O)C=1N(C)C(N(=O)=O)=NC1

Canonical SMILES

O=N(=O)C1=NC=C(N1C)COP(=O)(NCCBr)NCCBr

Other Names for this Substance

  • Phosphorodiamidic acid, N,N′-bis(2-bromoethyl)-, (1-methyl-2-nitro-1H-imidazol-5-yl)methyl ester
  • (1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N′-bis(2-bromoethyl)phosphorodiamidate
  • TH 302
  • Evofosfamide
  • 2-Bromo-N-[(2-bromoethylamino)-[(3-methyl-2-nitroimidazol-4-yl)methoxy]phosphoryl]ethanamine

CAS INSIGHTSTM
Targeted protein degrader structure, illustration