Structure

Ditiomustine

CAS
82599-22-2
Catalog Number
ACM82599222
Category
Other Products
Molecular Weight
421.328
Molecular Formula
C10H18Cl2N6O4S2

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Specification

IUPAC Name
1-(2-chloroethyl)-3-[2-[2-[[2-chloroethyl(nitroso)carbamoyl]amino]ethyldisulfanyl]ethyl]-1-nitrosourea
Canonical SMILES
C(CSSCCN(C(=O)NCCCl)N=O)NC(=O)N(CCCl)N=O
InChI Key
XWPCYYOZOJKYKQ-UHFFFAOYSA-N
Density
1.55g/cm³
Exact Mass
420.02100
H-Bond Acceptor
6
H-Bond Donor
2
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