Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-7-methyl-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide
Catalog ID
STK557640
SMILES CC1CCc2c(C1)c1c(=O)n(c3ccc(cc3)Cl)c3n(c1s2)c(SCC(=O)N)nn3
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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 C20H18ClN5O2S2 MW 459.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O2S2/c1-10-2-7-14-13(8-10)16-17(28)25(12-5-3-11(21)4-6-12)19-23-24-20(29-9-15(22)27)26(19)18(16)30-14/h3-6,10H,2,7-9H2,1H3,(H2,22,27)InChIKey
WDDOXWYFFNGFMF-UHFFFAOYSA-NSynonyms
575461-78-82((4(4chlorophenyl)7methyl5oxo456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetamide
2((4(4chlorophenyl)7methyl5oxo456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetamide
575461788
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)N)N(C3=O)C5=CC=C(C=C5)Cl
InChI=1SC20H18ClN5O2S2c110271413(810)1617(28)25(125311(21)4612)19232420(29915(22)27)26(19)18(16)3014h3610H279H21H3(H22227)
MFCD04026741
ZINC000002376944
ZINC000002376946
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