Anticancer agent 105

cas: 2450987-57-0 — see every product listed under this CAS number, including other names

Anticancer agent 105 (CAS 2450987-57-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2450987-57-0
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Structural formula: {0} (CAS {1})

Potassium (2Z,4Z)-1-amino-2-cyano-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-6-(4-methoxyphenyl)-1,6-dioxohexa-2,4-dien-3-olate (CAS 2450987-57-0) is a chemical compound with the molecular formula C25H24KN3O6S and a molecular weight of 533.6 g/mol. IUPAC name: potassium (2Z,4Z)-1-amino-2-cyano-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-6-(4-methoxyphenyl)-1,6-dioxohexa-2,4-dien-3-olate. InChIKey: YNTQHSIVXOWQKC-GGQHYGGTSA-M.

Identity
Molecular formulaC25H24KN3O6S
Molecular weight533.6 g/mol
IUPAC namepotassium (2Z,4Z)-1-amino-2-cyano-4-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-6-(4-methoxyphenyl)-1,6-dioxohexa-2,4-dien-3-olate
InChIKeyYNTQHSIVXOWQKC-GGQHYGGTSA-M
SMILESCCOC(=O)C1=C(SC2=C1CCCC2)N/C(=C\C(=O)C3=CC=C(C=C3)OC)/C(=C(\C#N)/C(=O)N)/[O-].[K+]

Computed by PubChem (NCBI)

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