Methyl 2-{(4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-5-yl)sulfanyl}acetate, 95%

cas: 312625-68-6 — see every product listed under this CAS number, including other names

Methyl 2-{(4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),5-trien-5-yl)sulfanyl}acetate, 95% (CAS 312625-68-6) is a chemical reagent available from Chemat. Available pack sizes: 5g. Offered by: AmBeed.

• 2D
• 3D

Methyl 2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate (CAS 312625-68-6) is a chemical compound with the molecular formula C20H20N2O3S2 and a molecular weight of 400.5 g/mol. IUPAC name: methyl 2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate. InChIKey: VWIPGSBRLLDKFI-UHFFFAOYSA-N.

Identity

Molecular formula	C20H20N2O3S2
Molecular weight	400.5 g/mol
IUPAC name	methyl 2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate
InChIKey	VWIPGSBRLLDKFI-UHFFFAOYSA-N
SMILES	CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)OC)SC4=C3CCCC4

Computed by PubChem (NCBI)

Synonyms: Oprea1_521597

Isomers (same molecular formula)

[3-[[3-(acetylsulfanylmethyl)-1-methylpyrazol-5-yl]methylsulfanyl]naphthalen-1-yl] acetate C₂₀H₂₀N₂O₃S₂

N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-phenylcyclopentane-1-carboxamide C₂₀H₂₀N₂O₃S₂