Vitas-M small molecule compound
(10E)-10-(3,5-dibromo-4-methoxybenzylidene)-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STL025933
SMILES COc1c(Br)cc(cc1Br)/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 C26H18Br2N2O2S2 MW 614.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18Br2N2O2S2/c1-32-24-18(27)11-14(12-19(24)28)13-21-25(31)30-23(20-7-4-10-33-20)17-9-8-15-5-2-3-6-16(15)22(17)29-26(30)34-21/h2-7,10-13,23H,8-9H2,1H3/b21-13+InChIKey
LESZSPWRHOTHDK-FYJGNVAPSA-NSynonyms
(10E)10(35dibromo4methoxybenzylidene)7(thiophen2yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10(35dibromo4methoxybenzylidene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=C(C=C(C=C1Br)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=CS6)Br
COc1c(Br)cc(cc1Br)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC26H18Br2N2O2S2c1322418(27)1114(1219(24)28)132125(31)3023(2074103320)179815523616(15)22(17)2926(30)3421h27101323H89H21H3b2113+
MFCD04227342
ZINC000103560187
ZINC000103560197
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