Vitas-M small molecule compound
methyl 3-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}propanoate
Catalog ID
STK531448
SMILES COC(=O)CCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
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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 C22H26N4O4S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S2/c1-22(2)10-13-14(11-30-22)19(26-5-7-29-8-6-26)25-20-16(13)17-18(32-20)21(24-12-23-17)31-9-4-15(27)28-3/h12H,4-11H2,1-3H3InChIKey
ARACPQQSWNJFND-UHFFFAOYSA-NSynonyms
CC1(CC2=C3C4=C(C(=NC=N4)SCCC(=O)OC)SC3=NC(=C2CO1)N5CCOCC5)C
InChI=1SC22H26N4O4S2c122(2)101314(113022)19(2657298626)252016(13)1718(3220)21(24122317)319415(27)283h12H411H213H3
methyl3((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)propanoate
methyl3((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)propanoate
MFCD02237397
ZINC000019940106
ZINC19940106
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