Vitas-M small molecule compound
2-[(11-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-1-(piperidin-1-yl)ethanone
Catalog ID
STL146199
SMILES CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)N1CCCCC1)nn2
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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 C20H23N7OS2 MW 441.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7OS2/c1-12-5-6-13-14(9-12)30-18-16(13)17-21-11-22-27(17)19-23-24-20(26(18)19)29-10-15(28)25-7-3-2-4-8-25/h11-12H,2-10H2,1H3InChIKey
NTHIJHQHLAACHE-UHFFFAOYSA-NSynonyms
861148-16-52((11methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)1(piperidin1yl)ethanone
2((11methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)1(piperidin1yl)ethanone
861148165
CC1CCC2=C(C1)SC3=C2C4=NC=NN4C5=NN=C(N35)SCC(=O)N6CCCCC6
InChI=1SC20H23N7OS2c112561314(912)301816(13)1721112227(17)19232420(26(18)19)291015(28)257324825h1112H210H21H3
MFCD05684367
ZINC000009308253
ZINC000009308254
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