Products 136941-85-0

CAS 136941-85-0 is the registry number for PCA50941. Offered by: GLPBio, Biosynth, MedChemExpress. Available pack sizes: 1mg, 10mg, 20mg, 5mg, Get quote.

PCA50941
GLPBio, Biosynth, MedChemExpress
  • size: 1mg, 10mg, 20mg, 5mg
  • Variants: 6
from 4800.13
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Structural formula: {0} (CAS {1})

5-O-(oxan-2-ylmethyl) 3-O-[2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate (CAS 136941-85-0) is a chemical compound with the molecular formula C30H31N3O10S and a molecular weight of 625.6 g/mol. IUPAC name: 5-O-(oxan-2-ylmethyl) 3-O-[2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate. InChIKey: SOOCCEZHZUEQKC-UHFFFAOYSA-N.

Identity
Molecular formulaC30H31N3O10S
Molecular weight625.6 g/mol
IUPAC name5-O-(oxan-2-ylmethyl) 3-O-[2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
InChIKeySOOCCEZHZUEQKC-UHFFFAOYSA-N
SMILESCC1=C(C(C(=C(N1)C)C(=O)OCC2CCCCO2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCN4C(=O)C5=CC=CC=C5S4(=O)=O

Computed by PubChem (NCBI)

Synonyms: Pca 50941, Pca-50941, orb1707872