Vitas-M small molecule compound
(10Z)-10-(3-bromo-4-ethoxy-5-methoxybenzylidene)-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK699282
SMILES CCOc1c(Br)cc(cc1OC)/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 C28H23BrN2O3S2 MW 579.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23BrN2O3S2/c1-3-34-26-20(29)13-16(14-21(26)33-2)15-23-27(32)31-25(22-9-6-12-35-22)19-11-10-17-7-4-5-8-18(17)24(19)30-28(31)36-23/h4-9,12-15,25H,3,10-11H2,1-2H3/b23-15-InChIKey
BDGGBSBDJZRSPB-HAHDFKILSA-NSynonyms
(10Z)10(3bromo4ethoxy5methoxybenzylidene)7(thiophen2yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10(3bromo4ethoxy5methoxybenzylidene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
CCOC1=C(C=C(C=C1Br)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=CS6)OC
CCOc1c(Br)cc(cc1OC)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC28H23BrN2O3S2c13342620(29)1316(1421(26)332)152327(32)3125(2296123522)19111017745818(17)24(19)3028(31)3623h49121525H31011H212H3b2315
MFCD03662911
ZINC000097968508
ZINC000097968509
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