Vitas-M small molecule compound
2-[(5-ethoxy-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-(piperidin-1-yl)ethanone
Catalog ID
STL234703
SMILES CCOc1nc2sc3c(c2c2n1c(SCC(=O)N1CCCCC1)nn2)CC(OC3)(C)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 C21H27N5O3S2 MW 461.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3S2/c1-4-28-19-22-18-16(13-10-21(2,3)29-11-14(13)31-18)17-23-24-20(26(17)19)30-12-15(27)25-8-6-5-7-9-25/h4-12H2,1-3H3InChIKey
AYVDHCIGVSIUCM-UHFFFAOYSA-NSynonyms
497077-99-32((5ethoxy1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)1(piperidin1yl)ethanone
2((5ethoxy1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)1(piperidin1yl)ethanone
497077993
CCOC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N41)SCC(=O)N5CCCCC5
InChI=1SC21H27N5O3S2c142819221816(131021(23)291114(13)3118)17232420(26(17)19)301215(27)258657925h412H213H3
MFCD03299358
ZINC000001241829
ZINC01241829
ZINC1241829
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