Vitas-M small molecule compound
(10E)-10-[3,5-diiodo-4-(prop-2-en-1-yloxy)benzylidene]-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STL025932
SMILES C=CCOc1c(I)cc(cc1I)/C=c\1/sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
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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 C28H20I2N2O2S2 MW 734.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20I2N2O2S2/c1-2-11-34-26-20(29)13-16(14-21(26)30)15-23-27(33)32-25(22-8-5-12-35-22)19-10-9-17-6-3-4-7-18(17)24(19)31-28(32)36-23/h2-8,12-15,25H,1,9-11H2/b23-15+InChIKey
XCTRDSDCLNGCQB-HZHRSRAPSA-NSynonyms
(10E)10(35diiodo4(prop2en1yloxy)benzylidene)7(thiophen2yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10(4(allyloxy)35diiodobenzylidene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C=CCOC1=C(C=C(C=C1I)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=CS6)I
C=CCOc1c(I)cc(cc1I)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC28H20I2N2O2S2c1211342620(29)1316(1421(26)30)152327(33)3225(2285123522)1910917634718(17)24(19)3128(32)3623h28121525H1911H2b2315+
MFCD04221491
ZINC000150481601
ZINC000150481603
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