Vitas-M small molecule compound
methyl {[3-(4-methoxyphenyl)-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK532552
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCN(C3)C
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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 C20H21N3O4S2 MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S2/c1-22-9-8-14-15(10-22)29-18-17(14)19(25)23(12-4-6-13(26-2)7-5-12)20(21-18)28-11-16(24)27-3/h4-7H,8-11H2,1-3H3InChIKey
CFKKKUALHNBZGS-UHFFFAOYSA-NSynonyms
CN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)OC)C4=CC=C(C=C4)OC
InChI=1SC20H21N3O4S2c122981415(1022)291817(14)19(25)23(124613(262)7512)20(2118)281116(24)273h47H811H213H3
methyl((3(4methoxyphenyl)7methyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((3(4methoxyphenyl)7methyl4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetate
methyl2((3(4methoxyphenyl)7methyl4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
MFCD02234942
ZINC000019939782
ZINC19939782
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