Vitas-M small molecule compound
(10Z)-10-{3-[(4-bromobenzyl)oxy]benzylidene}-7-(3,4-dimethoxyphenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK006348
SMILES COc1ccc(cc1OC)C1C2=C(N=c3n1c(=O)/c(=C/c1cccc(c1)OCc1ccc(cc1)Br)/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 C36H29BrN2O4S MW 665.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29BrN2O4S/c1-41-30-17-13-25(20-31(30)42-2)34-29-16-12-24-7-3-4-9-28(24)33(29)38-36-39(34)35(40)32(44-36)19-23-6-5-8-27(18-23)43-21-22-10-14-26(37)15-11-22/h3-11,13-15,17-20,34H,12,16,21H2,1-2H3/b32-19-InChIKey
BHNCZZDMCDLWMO-MZFJOGFUSA-NSynonyms
(10Z)10(3((4BROMOBENZYL)OXY)BENZYLIDENE)7(34DIMETHOXYPHENYL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)10(3((4bromobenzyl)oxy)benzylidene)7(34dimethoxyphenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=C(C=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CC(=CC=C6)OCC7=CC=C(C=C7)Br)S5)OC
COc1ccc(cc1OC)C1C2=C(N=c3n1c(=O)c(=Cc1cccc(c1)OCc1ccc(cc1)Br)s3)c1c(CC2)cccc1
InChI=1SC36H29BrN2O4Sc14130171325(2031(30)422)3429161224734928(24)33(29)383639(34)35(40)32(4436)192365827(1823)432122101426(37)151122h3111315172034H121621H212H3b3219
MFCD03665269
STK006348
ZINC000097957798
ZINC000097957799
Check stock
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