Vitas-M small molecule compound
ethyl [(3-benzyl-7-ethyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK033306
SMILES CCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)CC
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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 C22H25N3O3S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S2/c1-3-24-11-10-16-17(13-24)30-20-19(16)21(27)25(12-15-8-6-5-7-9-15)22(23-20)29-14-18(26)28-4-2/h5-9H,3-4,10-14H2,1-2H3InChIKey
KRANXPVPRIAWLK-UHFFFAOYSA-NSynonyms
369608-75-3369608753
CCN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)OCC)CC4=CC=CC=C4
CCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)CC
ethyl((3benzyl7ethyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((3benzyl7ethyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetate
ethyl2((3benzyl7ethyl4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
InChI=1SC22H25N3O3S2c132411101617(1324)302019(16)21(27)25(12158657915)22(2320)291418(26)2842h59H341014H212H3
MFCD01556883
STK033306
ZINC000020813440
ZINC20813440
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