Vitas-M small molecule compound
{7-methyl-2,4-dioxo-1-[2-(piperidin-1-yl)ethyl]-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl}acetic acid
Catalog ID
STK614769
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CCN1CCCCC1)CC(=O)O
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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 C20H27N3O4S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4S/c1-13-5-6-14-15(11-13)28-19-17(14)18(26)23(12-16(24)25)20(27)22(19)10-9-21-7-3-2-4-8-21/h13H,2-12H2,1H3,(H,24,25)InChIKey
LBAGMTUXNRCEMX-UHFFFAOYSA-NSynonyms
903590-90-9(7methyl24dioxo1(2(piperidin1yl)ethyl)145678hexahydro(1)benzothieno(23d)pyrimidin3(2H)yl)aceticacid
2(7methyl24dioxo1(2(piperidin1yl)ethyl)125678hexahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)aceticacid
2(7methyl24dioxo1(2piperidin1ylethyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)aceticacid
903590909
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=O)N3CCN4CCCCC4)CC(=O)O
InChI=1SC20H27N3O4Sc113561415(1113)281917(14)18(26)23(1216(24)25)20(27)22(19)109217324821h13H212H21H3(H2425)
MFCD08292145
ZINC000006760521
ZINC000006760522
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