Vitas-M small molecule compound
{[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}acetic acid
Catalog ID
STL323470
SMILES OC(=O)CSc1ncnc2c1sc1c2c2CC(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 C20H22N4O4S2 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S2/c1-20(2)7-11-12(8-28-20)17(24-3-5-27-6-4-24)23-18-14(11)15-16(30-18)19(22-10-21-15)29-9-13(25)26/h10H,3-9H2,1-2H3,(H,25,26)InChIKey
JQNILHWWLFSLDH-UHFFFAOYSA-NSynonyms
303051-65-2((22dimethyl5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)aceticacid
2((22dimethyl5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)aceticacid
303051652
CC1(CC2=C3C4=C(C(=(NH+)C=N4)SCC(=O)(O))SC3=NC(=C2CO1)N5CCOCC5)C
InChI=1SC20H22N4O4S2c120(2)71112(82820)17(2435276424)231814(11)1516(3018)19(22102115)29913(25)26h10H39H212H3(H2526)
MFCD01556816
ZINC000002259005
ZINC2259005
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