Vitas-M small molecule compound
4-(4-methoxyphenyl)-1-sulfanyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK699039
SMILES COc1ccc(cc1)n1c(=O)c2c3CCCCc3sc2n2c1nnc2S
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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 C18H16N4O2S2 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S2/c1-24-11-8-6-10(7-9-11)21-15(23)14-12-4-2-3-5-13(12)26-16(14)22-17(21)19-20-18(22)25/h6-9H,2-5H2,1H3,(H,20,25)InChIKey
SOBTUGIRQVZWEC-UHFFFAOYSA-NSynonyms
354992-49-71mercapto4(4methoxyphenyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
354992497
4(4methoxyphenyl)1sulfanyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
COC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NNC4=S)SC5=C3CCCC5
InChI=1SC18H16N4O2S2c124118610(7911)2115(23)1412423513(12)2616(14)2217(21)192018(22)25h69H25H21H3(H2025)
MFCD01875289
ZINC000013154426
ZINC13154426
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