Vitas-M small molecule compound
8-(4-methoxyphenyl)-9-thioxo-5,8,9,10-tetrahydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Catalog ID
STL036796
SMILES COc1ccc(cc1)n1c(=S)[nH]c2c(c1=O)c1CCc3c(c1s2)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 C21H16N2O2S2 MW 392.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O2S2/c1-25-14-9-7-13(8-10-14)23-20(24)17-16-11-6-12-4-2-3-5-15(12)18(16)27-19(17)22-21(23)26/h2-5,7-10H,6,11H2,1H3,(H,22,26)InChIKey
VDYNTXXHZMEDPD-UHFFFAOYSA-NSynonyms
8(4methoxyphenyl)9thioxo58910tetrahydronaphtho(2145)thieno(23d)pyrimidin7(6H)one
COC1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC4=C3CCC5=CC=CC=C54
COc1ccc(cc1)n1c(=S)(nH)c2c(c1=O)c1CCc3c(c1s2)cccc3
InChI=1SC21H16N2O2S2c125149713(81014)2320(24)171611612423515(12)18(16)2719(17)2221(23)26h25710H611H21H3(H2226)
MFCD03813231
ZINC000004811871
ZINC04811871
ZINC4811871
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