Vitas-M small molecule compound
3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK905092
SMILES S=C1S/C(=C\c2c(Oc3ccccc3)nc3n(c2=O)cccc3)/C(=O)N1Cc1ccc2c(c1)OCO2
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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 C26H17N3O5S2 MW 515.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N3O5S2/c30-24-18(23(34-17-6-2-1-3-7-17)27-22-8-4-5-11-28(22)24)13-21-25(31)29(26(35)36-21)14-16-9-10-19-20(12-16)33-15-32-19/h1-13H,14-15H2/b21-13-InChIKey
HGDISXRSEUCRCS-BKUYFWCQSA-NSynonyms
(5Z)3(13benzodioxol5ylmethyl)5((4oxo2phenoxypyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2phenoxy4Hpyrido(12a)pyrimidin4one
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=C(N=C5C=CC=CN5C4=O)OC6=CC=CC=C6)SC3=S
InChI=1SC26H17N3O5S2c302418(23(34176213717)27228451128(22)24)132125(31)29(26(35)3621)14169101920(1216)33153219h113H1415H2b2113
MFCD18076248
S=C1SC(=Cc2c(Oc3ccccc3)nc3n(c2=O)cccc3)C(=O)N1Cc1ccc2c(c1)OCO2
ZINC000040221223
ZINC40221223
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