Products 1047981-31-6

CAS 1047981-31-6 appears in our catalog under these names: AFN-1252 tosylate, AFN-1252 (tosylate). Offered by: TargetMol, MedChemExpress. Available pack sizes: 25mg, Get quote.

AFN-1252 tosylate
TargetMol
  • size: 25mg
  • Variants: 1
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AFN-1252 (tosylate)
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

4-methylbenzenesulfonic acid;(E)-N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)prop-2-enamide (CAS 1047981-31-6) is a chemical compound with the molecular formula C29H29N3O6S and a molecular weight of 547.6 g/mol. IUPAC name: 4-methylbenzenesulfonic acid;(E)-N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)prop-2-enamide. InChIKey: NHTYVWVPSCBFQW-HCUGZAAXSA-N.

Identity
Molecular formulaC29H29N3O6S
Molecular weight547.6 g/mol
IUPAC name4-methylbenzenesulfonic acid;(E)-N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)prop-2-enamide
InChIKeyNHTYVWVPSCBFQW-HCUGZAAXSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O.CC1=C(OC2=CC=CC=C12)CN(C)C(=O)/C=C/C3=CC4=C(NC(=O)CC4)N=C3

Computed by PubChem (NCBI)

Synonyms: orb1690149
Isomers (same molecular formula)
(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-6-(2-isothiocyanato-1-pyridin-3-ylethyl)-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline C29H29N3O6S