Vitas-M small molecule compound
(2E)-6-(4-methylbenzyl)-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK823932
SMILES Cc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C/c1ccc(o1)c1ccccc1[N+](=O)[O-])/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 C24H16N4O5S MW 472.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16N4O5S/c1-14-6-8-15(9-7-14)12-18-22(29)25-24-27(26-18)23(30)21(34-24)13-16-10-11-20(33-16)17-4-2-3-5-19(17)28(31)32/h2-11,13H,12H2,1H3/b21-13+InChIKey
BQKOHPAFMAQZRZ-FYJGNVAPSA-NSynonyms
(2E)6((4methylphenyl)methyl)2((5(2nitrophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazine37dione
(2E)6(4methylbenzyl)2((5(2nitrophenyl)furan2yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
CC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O))SC3=NC2=O
Cc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))c2=O
InChI=1SC24H16N4O5Sc1146815(9714)121822(29)252427(2618)23(30)21(3424)1316101120(3316)17423519(17)28(31)32h21113H12H21H3b2113+
MFCD18075773
ZINC000026779472
ZINC26779472
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