Vitas-M small molecule compound
(10E)-10-[4-(benzyloxy)-3,5-dibromobenzylidene]-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK326067
SMILES Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C\c1cc(Br)c(c(c1)Br)OCc1ccccc1)/s3)c1c(CC2)cccc1
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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 C34H23Br2FN2O2S MW 702.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H23Br2FN2O2S/c35-27-16-21(17-28(36)32(27)41-19-20-6-2-1-3-7-20)18-29-33(40)39-31(23-10-13-24(37)14-11-23)26-15-12-22-8-4-5-9-25(22)30(26)38-34(39)42-29/h1-11,13-14,16-18,31H,12,15,19H2/b29-18+InChIKey
IAWUYXMMHOMVEF-RDRPBHBLSA-NSynonyms
(10E)10(4(benzyloxy)35dibromobenzylidene)7(4fluorophenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10(4(benzyloxy)35dibromobenzylidene)7(4fluorophenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)F)C(=O)C(=CC6=CC(=C(C(=C6)Br)OCC7=CC=CC=C7)Br)S4
Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1cc(Br)c(c(c1)Br)OCc1ccccc1)s3)c1c(CC2)cccc1
InChI=1SC34H23Br2FN2O2Sc35271621(1728(36)32(27)4119206213720)182933(40)3931(23101324(37)141123)26151222845925(22)30(26)3834(39)4229h1111314161831H121519H2b2918+
MFCD04227296
ZINC000097962568
ZINC000097962569
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