Products 3010895-54-9

CAS 3010895-54-9 is the registry number for CYP2C1/CYP2C19-IN-2. Offered by: MedChemExpress. Available pack sizes: Get quote.

CYP2C1/CYP2C19-IN-2
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Structural formula: {0} (CAS {1})

[6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-ethoxyphenyl]naphthalen-2-yl]methanesulfonic acid (CAS 3010895-54-9) is a chemical compound with the molecular formula C27H28N2O6S and a molecular weight of 508.6 g/mol. IUPAC name: [6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-ethoxyphenyl]naphthalen-2-yl]methanesulfonic acid. InChIKey: VAVZLJOJVDFJBE-UHFFFAOYSA-N.

Identity
Molecular formulaC27H28N2O6S
Molecular weight508.6 g/mol
IUPAC name[6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-ethoxyphenyl]naphthalen-2-yl]methanesulfonic acid
InChIKeyVAVZLJOJVDFJBE-UHFFFAOYSA-N
SMILESCCOC1=C(C=C(C=C1C(C)(C)C)N2C=CC(=O)NC2=O)C3=CC4=C(C=C3)C=C(C=C4)CS(=O)(=O)O

Computed by PubChem (NCBI)

Isomers (same molecular formula)
1-[methyl-(4-methylphenyl)sulfonylamino]ethenyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate C27H28N2O6S
methyl 3-(5-acetamido-2-phenylmethoxyphenyl)sulfanyl-2-(phenylmethoxycarbonylamino)propanoate C27H28N2O6S
2-[6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-methoxyphenyl]naphthalen-2-yl]ethanesulfonic acid C27H28N2O6S

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