Vitas-M small molecule compound
(10E)-10-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxybenzylidene}-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK019087
SMILES COc1cc(cc(c1OCc1ccccc1Cl)Br)/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 C33H24BrClN2O3S2 MW 676.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24BrClN2O3S2/c1-39-26-16-19(15-24(34)31(26)40-18-21-8-3-5-10-25(21)35)17-28-32(38)37-30(27-11-6-14-41-27)23-13-12-20-7-2-4-9-22(20)29(23)36-33(37)42-28/h2-11,14-17,30H,12-13,18H2,1H3/b28-17+InChIKey
DBLSEBHQVQWXJD-OGLMXYFKSA-NSynonyms
(10E)10(3BROMO4((2CHLOROBENZYL)OXY)5METHOXYBENZYLIDENE)7(THIOPHEN2YL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)10(3bromo4((2chlorobenzyl)oxy)5methoxybenzylidene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=C(C(=CC(=C1)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=CS6)Br)OCC7=CC=CC=C7Cl
COc1cc(cc(c1OCc1ccccc1Cl)Br)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC33H24BrClN2O3S2c139261619(1524(34)31(26)4018218351025(21)35)172832(38)3730(27116144127)23131220724922(20)29(23)3633(37)4228h211141730H121318H21H3b2817+
MFCD04221487
STK019087
ZINC000097958006
ZINC000097958007
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