Sadopine

cas: 111127-62-9 — see every product listed under this CAS number, including other names

Sadopine (CAS 111127-62-9) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas111127-62-9
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Structural formula: {0} (CAS {1})

3-O-ethyl 5-O-[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]ethyl] 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate (CAS 111127-62-9) is a chemical compound with the molecular formula C30H40F3N3O7S and a molecular weight of 643.7 g/mol. IUPAC name: 3-O-ethyl 5-O-[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]ethyl] 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate. InChIKey: IAGRRCQYHMPXJH-UHFFFAOYSA-N.

Identity
Molecular formulaC30H40F3N3O7S
Molecular weight643.7 g/mol
IUPAC name3-O-ethyl 5-O-[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]ethyl] 2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
InChIKeyIAGRRCQYHMPXJH-UHFFFAOYSA-N
SMILESCCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(F)(F)F)C(=O)OCCNC(=O)C(CCSC)NC(=O)OC(C)(C)C)C)C

Computed by PubChem (NCBI)

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