Vitas-M small molecule compound
3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-bromophenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK905087
SMILES Brc1ccc(cc1)Oc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(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 C26H16BrN3O5S2 MW 594.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16BrN3O5S2/c27-16-5-7-17(8-6-16)35-23-18(24(31)29-10-2-1-3-22(29)28-23)12-21-25(32)30(26(36)37-21)13-15-4-9-19-20(11-15)34-14-33-19/h1-12H,13-14H2/b21-12-InChIKey
FHASBCURURCAIU-MTJSOVHGSA-NSynonyms
(5Z)3(13benzodioxol5ylmethyl)5((2(4bromophenoxy)4oxopyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(13benzodioxol5ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4bromophenoxy)4Hpyrido(12a)pyrimidin4one
Brc1ccc(cc1)Oc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=C(N=C5C=CC=CN5C4=O)OC6=CC=C(C=C6)Br)SC3=S
InChI=1SC26H16BrN3O5S2c27165717(8616)352318(24(31)291021322(29)2823)122125(32)30(26(36)3721)1315491920(1115)34143319h112H1314H2b2112
MFCD18076243
ZINC000097947390
ZINC97947390
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