Vitas-M small molecule compound
ethyl [(2,12-dimethyl-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]acetate
Catalog ID
STL303881
SMILES CCOC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(CC3)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 C18H20N6O2S2 MW 416.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O2S2/c1-4-26-13(25)8-27-18-21-20-17-23(18)16-14(15-19-10(3)22-24(15)17)11-7-9(2)5-6-12(11)28-16/h9H,4-8H2,1-3H3InChIKey
XNACIGHOZZEMDK-UHFFFAOYSA-NSynonyms
848925-21-3848925213
CCOC(=O)CSC1=NN=C2N1C3=C(C4=C(S3)CCC(C4)C)C5=NC(=NN52)C
ethyl((212dimethyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a15c)pyrimidin7yl)sulfanyl)acetate
ethyl2((212dimethyl10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a15c)pyrimidin7yl)thio)acetate
InChI=1SC18H20N6O2S2c142613(25)8271821201723(18)1614(151910(3)2224(15)17)1179(2)5612(11)2816h9H48H213H3
MFCD05677854
ZINC000002443688
ZINC000002443689
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