Vitas-M small molecule compound
4-(3,4-diethoxybenzyl)-1-thioxo-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STL135287
SMILES CCOc1cc(ccc1OCC)Cn1c(=O)c2sccc2n2c1n[nH]c2=S
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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 C18H18N4O3S2 MW 402.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S2/c1-3-24-13-6-5-11(9-14(13)25-4-2)10-21-16(23)15-12(7-8-27-15)22-17(21)19-20-18(22)26/h5-9H,3-4,10H2,1-2H3,(H,20,26)InChIKey
MQILGCVJCPSKQI-UHFFFAOYSA-NSynonyms
1031669-41-61031669416
4(34diethoxybenzyl)1thioxo24dihydrothieno(23e)(124)triazolo(43a)pyrimidin5(1H)one
CCOC1=C(C=C(C=C1)CN2C(=O)C3=C(C=CS3)N4C2=NNC4=S)OCC
CCOc1cc(ccc1OCC)Cn1c(=O)c2sccc2n2c1n(nH)c2=S
InChI=1SC18H18N4O3S2c1324136511(914(13)2542)102116(23)1512(782715)2217(21)192018(22)26h59H3410H212H3(H2026)
MFCD14728388
ZINC000021729893
ZINC21729893
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