Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK817274
SMILES S=C1S/C(=C\c2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)/C(=O)N1C
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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 C21H16N4O4S2 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O4S2/c1-24-20(27)16(31-21(24)30)9-13-18(23-17-4-2-3-7-25(17)19(13)26)22-10-12-5-6-14-15(8-12)29-11-28-14/h2-9,22H,10-11H2,1H3/b16-9-InChIKey
OSQMFIHRTGFTIV-SXGWCWSVSA-NSynonyms
(5Z)5((2(13BENZODIOXOL5YLMETHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
2((13benzodioxol5ylmethyl)amino)3((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC4=CC5=C(C=C4)OCO5)SC1=S
InChI=1SC21H16N4O4S2c12420(27)16(3121(24)30)91318(2317423725(17)19(13)26)221012561415(812)29112814h2922H1011H21H3b169
MFCD03212782
S=C1SC(=Cc2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)C(=O)N1C
ZINC000016734049
ZINC16734049
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