Vitas-M small molecule compound
methyl [(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetate
Catalog ID
STK545083
SMILES COC(=O)CSc1nnc2n1c(CC)nc1c2c2CCCCc2s1
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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 C16H18N4O2S2 MW 362.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O2S2/c1-3-11-17-15-13(9-6-4-5-7-10(9)24-15)14-18-19-16(20(11)14)23-8-12(21)22-2/h3-8H2,1-2H3InChIKey
KDJOCPAFXFNESG-UHFFFAOYSA-NSynonyms
489404-08-2489404082
CCC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SCC(=O)OC
InChI=1SC16H18N4O2S2c1311171513(9645710(9)2415)14181916(20(11)14)23812(21)222h38H212H3
methyl((5ethyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
methyl2((5ethyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
MFCD03296107
ZINC000001302632
ZINC01302632
ZINC1302632
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