Nimustine

CAS Registry Number®

42471-28-3
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CAS Name

Nimustine

Molecular Formula

C9H13ClN6O2

Molecular Mass

272.69

Cite this Page

Nimustine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=42471-28-3 (retrieved 2024-04-19) (CAS RN: 42471-28-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    125 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C9H13ClN6O2/c1-6-12-4-7(8(11)14-6)5-13-9(17)16(15-18)3-2-10/h4H,2-3,5H2,1H3,(H,13,17)(H2,11,12,14)

InChIKey

InChIKey=VFEDRRNHLBGPNN-UHFFFAOYSA-N

SMILES

C(NC(N(CCCl)N=O)=O)C=1C(N)=NC(C)=NC1

Canonical SMILES

O=NN(C(=O)NCC1=CN=C(N=C1N)C)CCCl

Other Names for this Substance

  • Urea, N′-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(2-chloroethyl)-N-nitroso-
  • N′-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-N-(2-chloroethyl)-N-nitrosourea
  • Nimustine
  • NSC 245382
  • 1-(4-Amino-2-methyl-5-pyrimidinyl)methyl-3-(2-chloroethyl)-3-nitrosourea

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