Vitas-M small molecule compound
(10Z)-10-{5-bromo-2-[(4-nitrobenzyl)oxy]benzylidene}-7-(4-methoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK699288
SMILES COc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C/c1cc(Br)ccc1OCc1ccc(cc1)[N+](=O)[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 C35H26BrN3O5S MW 680.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26BrN3O5S/c1-43-27-14-8-23(9-15-27)33-29-16-10-22-4-2-3-5-28(22)32(29)37-35-38(33)34(40)31(45-35)19-24-18-25(36)11-17-30(24)44-20-21-6-12-26(13-7-21)39(41)42/h2-9,11-15,17-19,33H,10,16,20H2,1H3/b31-19-InChIKey
JBQAPADICHJJBM-DXJNIWACSA-NSynonyms
(10Z)10(5bromo2((4nitrobenzyl)oxy)benzylidene)7(4methoxyphenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(E)10(5bromo2((4nitrobenzyl)oxy)benzylidene)7(4methoxyphenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=C(C=CC(=C6)Br)OCC7=CC=C(C=C7)(N+)(=O)(O))S5
COc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1cc(Br)ccc1OCc1ccc(cc1)(N+)(=O)(O))s3)c1c(CC2)cccc1
InChI=1SC35H26BrN3O5Sc1432714823(91527)3329161022423528(22)32(29)373538(33)34(40)31(4535)19241825(36)111730(24)44202161226(13721)39(41)42h291115171933H101620H21H3b3119
MFCD13371084
ZINC000150467551
ZINC000150467554
Check stock
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