Vitas-M small molecule compound
2-{2-[(4-amino-6-ethyl-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK550865
SMILES CCC1(C)OCc2c(C1)c1c(N)nc(nc1s2)SCCN1C(=O)c2c(C1=O)cccc2
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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 C22H22N4O3S2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S2/c1-3-22(2)10-14-15(11-29-22)31-18-16(14)17(23)24-21(25-18)30-9-8-26-19(27)12-6-4-5-7-13(12)20(26)28/h4-7H,3,8-11H2,1-2H3,(H2,23,24,25)InChIKey
HOKAULZXOHOHOQ-UHFFFAOYSA-NSynonyms
799777-79-02(2((4amino6ethyl6methyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)ethyl)1Hisoindole13(2H)dione
2(2((4amino6ethyl6methyl58dihydropyrano(45)thieno(12c)pyrimidin2yl)sulfanyl)ethyl)isoindole13dione
2(2((4amino6ethyl6methyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)ethyl)isoindoline13dione
799777790
CCC1(CC2=C(CO1)SC3=NC(=NC(=C23)N)SCCN4C(=O)C5=CC=CC=C5C4=O)C
InChI=1SC22H22N4O3S2c1322(2)101415(112922)311816(14)17(23)2421(2518)30982619(27)12645713(12)20(26)28h47H3811H212H3(H2232425)
MFCD03673309
ZINC000002209999
ZINC000002210000
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