Ambamustine

cas: 85754-59-2 — see every product listed under this CAS number, including other names

Ambamustine (CAS 85754-59-2) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-19577-Get quote
cas85754-59-2
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Structural formula: {0} (CAS {1})

Ethyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-fluorophenyl)propanoyl]amino]-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-4-methylsulfanylbutanoate (CAS 85754-59-2) is a chemical compound with the molecular formula C29H39Cl2FN4O4S and a molecular weight of 629.6 g/mol. IUPAC name: ethyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-fluorophenyl)propanoyl]amino]-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-4-methylsulfanylbutanoate. InChIKey: XPGDODOEEWLHOI-GSDHBNRESA-N.

Identity
Molecular formulaC29H39Cl2FN4O4S
Molecular weight629.6 g/mol
IUPAC nameethyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-fluorophenyl)propanoyl]amino]-3-[3-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-4-methylsulfanylbutanoate
InChIKeyXPGDODOEEWLHOI-GSDHBNRESA-N
SMILESCCOC(=O)[C@H](CCSC)NC(=O)[C@H](CC1=CC(=CC=C1)N(CCCl)CCCl)NC(=O)[C@H](CC2=CC=C(C=C2)F)N

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