Vitas-M small molecule compound
methyl {[5-(butylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Catalog ID
STK941124
SMILES CCCCSc1nc2sc3c(c2c2n1c(SCC(=O)OC)nn2)CCCC3
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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 C18H22N4O2S3 MW 422.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S3/c1-3-4-9-25-17-19-16-14(11-7-5-6-8-12(11)27-16)15-20-21-18(22(15)17)26-10-13(23)24-2/h3-10H2,1-2H3InChIKey
RKQRXPVEOUCGFZ-UHFFFAOYSA-NSynonyms
850802-33-4850802334
CCCCSC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCC(=O)OC
InChI=1SC18H22N4O2S3c13492517191614(11756812(11)2716)15202118(22(15)17)261013(23)242h310H212H3
methyl((5(butylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
methyl2((5(butylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
MFCD05695604
ZINC000002437659
ZINC02437659
ZINC2437659
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