Vitas-M small molecule compound
(2Z)-2-{[5-(4-bromophenyl)furan-2-yl]methylidene}-6-(4-chlorobenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK905167
SMILES Clc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C\c1ccc(o1)c1ccc(cc1)Br)/c2=O
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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 C23H13BrClN3O3S MW 526.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13BrClN3O3S/c24-15-5-3-14(4-6-15)19-10-9-17(31-19)12-20-22(30)28-23(32-20)26-21(29)18(27-28)11-13-1-7-16(25)8-2-13/h1-10,12H,11H2/b20-12-InChIKey
MGAASVPRUMMLOJ-NDENLUEZSA-NSynonyms
(2Z)2((5(4bromophenyl)furan2yl)methylidene)6((4chlorophenyl)methyl)(13)thiazolo(32b)(124)triazine37dione
(2Z)2((5(4bromophenyl)furan2yl)methylidene)6(4chlorobenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
C1=CC(=CC=C1CC2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)Br)SC3=NC2=O)Cl
Clc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(o1)c1ccc(cc1)Br)c2=O
InChI=1SC23H13BrClN3O3Sc24155314(4615)1910917(3119)122022(30)2823(3220)2621(29)18(2728)11131716(25)8213h11012H11H2b2012
MFCD18076288
ZINC000097947401
ZINC97947401
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