Vitas-M small molecule compound

methyl {[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate

Catalog ID
STK325596
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCCC3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H20N2O4S2 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4S2/c1-25-13-9-7-12(8-10-13)22-19(24)17-14-5-3-4-6-15(14)28-18(17)21-20(22)27-11-16(23)26-2/h7-10H,3-6,11H2,1-2H3
InChIKey
LNPLMRNGQZBGLF-UHFFFAOYSA-N
Synonyms
312625-73-3
312625733
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)OC)SC4=C3CCCC4
InChI=1SC20H20N2O4S2c125139712(81013)2219(24)1714534615(14)2818(17)2120(22)271116(23)262h710H3611H212H3
methyl((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
MFCD01907345
ZINC000000754053
ZINC00754053
ZINC754053

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.