Vitas-M small molecule compound
2-[(2-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-phenylethanone
Catalog ID
STK574947
SMILES Cc1nn2c(n1)c1c3CCCCc3sc1n1c2nnc1SCC(=O)c1ccccc1
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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 C21H18N6OS2 MW 434.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N6OS2/c1-12-22-18-17-14-9-5-6-10-16(14)30-19(17)26-20(27(18)25-12)23-24-21(26)29-11-15(28)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-11H2,1H3InChIKey
HIPVTWOLIAIGAJ-UHFFFAOYSA-NSynonyms
850187-89-22((2methyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)1phenylethanone
2((2methyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)1phenylethanone
850187892
CC1=NN2C(=N1)C3=C(N4C2=NN=C4SCC(=O)C5=CC=CC=C5)SC6=C3CCCC6
InChI=1SC21H18N6OS2c112221817149561016(14)3019(17)2620(27(18)2512)232421(26)291115(28)137324813h2478H56911H21H3
MFCD05690317
ZINC000002231952
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