Vitas-M small molecule compound
(10E)-10-(3-bromo-4-hydroxybenzylidene)-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK073946
SMILES Clc1ccccc1C1C2=C(N=c3n1c(=O)/c(=C\c1ccc(c(c1)Br)O)/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 C27H18BrClN2O2S MW 549.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18BrClN2O2S/c28-20-13-15(9-12-22(20)32)14-23-26(33)31-25(18-7-3-4-8-21(18)29)19-11-10-16-5-1-2-6-17(16)24(19)30-27(31)34-23/h1-9,12-14,25,32H,10-11H2/b23-14+InChIKey
XTLUGAKTVXLBGI-OEAKJJBVSA-NSynonyms
(10E)10(3BROMO4HYDROXYBENZYLIDENE)7(2CHLOROPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)10(3bromo4hydroxybenzylidene)7(2chlorophenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=CC=C5Cl)C(=O)C(=CC6=CC(=C(C=C6)O)Br)S4
Clc1ccccc1C1C2=C(N=c3n1c(=O)c(=Cc1ccc(c(c1)Br)O)s3)c1c(CC2)cccc1
InChI=1SC27H18BrClN2O2Sc28201315(91222(20)32)142326(33)3125(18734821(18)29)19111016512617(16)24(19)3027(31)3423h1912142532H1011H2b2314+
MFCD02784047
STK073946
ZINC000100956989
ZINC000100956990
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