Products 2939851-67-7
CAS 2939851-67-7 is the registry number for HE-S2. Offered by: MedChemExpress. Available pack sizes: Get quote.
[4-[[2-amino-4-(butylamino)pyrido[3,2-d]pyrimidin-6-yl]methyl]phenyl]methyl-dimethyl-[[4-[[(2R)-2-[(5-nitro-2-pyridinyl)disulfanyl]propoxy]carbonylamino]phenyl]methyl]azanium formate (CAS 2939851-67-7) is a chemical compound with the molecular formula C38H45N9O6S2 and a molecular weight of 788.0 g/mol. IUPAC name: [4-[[2-amino-4-(butylamino)pyrido[3,2-d]pyrimidin-6-yl]methyl]phenyl]methyl-dimethyl-[[4-[[(2R)-2-[(5-nitro-2-pyridinyl)disulfanyl]propoxy]carbonylamino]phenyl]methyl]azanium formate. InChIKey: UNONHPRCWDOFSQ-VQIWEWKSSA-N.
| Molecular formula | C38H45N9O6S2 |
|---|---|
| Molecular weight | 788.0 g/mol |
| IUPAC name | [4-[[2-amino-4-(butylamino)pyrido[3,2-d]pyrimidin-6-yl]methyl]phenyl]methyl-dimethyl-[[4-[[(2R)-2-[(5-nitro-2-pyridinyl)disulfanyl]propoxy]carbonylamino]phenyl]methyl]azanium formate |
| InChIKey | UNONHPRCWDOFSQ-VQIWEWKSSA-N |
| SMILES | CCCCNC1=NC(=NC2=C1N=C(C=C2)CC3=CC=C(C=C3)C[N+](C)(C)CC4=CC=C(C=C4)NC(=O)OC[C@@H](C)SSC5=NC=C(C=C5)[N+](=O)[O-])N.C(=O)[O-] |
Computed by PubChem (NCBI)