Products 1958012-13-9

CAS 1958012-13-9 is the registry number for 4-Ethynyl-1,4-dihydro-6-methyl-1-[(4-methylphenyl)sulfonyl]-2H-3,1-benzoxazin-2-one, 98%. Offered by: Chemat Brand. Available pack sizes: on request.

4-Ethynyl-1,4-dihydro-6-methyl-1-[(4-methylphenyl)sulfonyl]-2H-3,1-benzoxazin-2-one, 98%
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

4-ethynyl-6-methyl-1-(4-methylphenyl)sulfonyl-4H-3,1-benzoxazin-2-one (CAS 1958012-13-9) is a chemical compound with the molecular formula C18H15NO4S and a molecular weight of 341.4 g/mol. IUPAC name: 4-ethynyl-6-methyl-1-(4-methylphenyl)sulfonyl-4H-3,1-benzoxazin-2-one. InChIKey: BSUABDDMTRMZMW-UHFFFAOYSA-N.

Identity
Molecular formulaC18H15NO4S
Molecular weight341.4 g/mol
IUPAC name4-ethynyl-6-methyl-1-(4-methylphenyl)sulfonyl-4H-3,1-benzoxazin-2-one
InChIKeyBSUABDDMTRMZMW-UHFFFAOYSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)C)C(OC2=O)C#C

Computed by PubChem (NCBI)

Isomers (same molecular formula)
8-hydroxy-3-methyl-7-(4-methylsulfonylphenyl)isoquinoline-5-carbaldehyde C18H15NO4S
4-ethynyl-8-methyl-1-(4-methylphenyl)sulfonyl-4H-3,1-benzoxazin-2-one C18H15NO4S
4-ethynyl-5-methyl-1-(4-methylphenyl)sulfonyl-4H-3,1-benzoxazin-2-one C18H15NO4S
4-[(naphthalen-2-ylsulfonylamino)methyl]benzoic acid C18H15NO4S
4-ethynyl-4-methyl-1-(4-methylphenyl)sulfonyl-3,1-benzoxazin-2-one C18H15NO4S
methyl 3-[5-(benzylcarbamoyl)furan-2-yl]thiophene-2-carboxylate C18H15NO4S