Vitas-M small molecule compound
6-{(2Z)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-N-(4-methoxyphenyl)-N'-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine
Catalog ID
STK668972
SMILES COc1ccc(cc1)Nc1nc(N/N=C\C(=C\c2ccccc2)\Br)nc(n1)Nc1ccc(cc1)[N+](=O)[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 C25H21BrN8O3 MW 561.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN8O3/c1-37-22-13-9-20(10-14-22)29-24-30-23(28-19-7-11-21(12-8-19)34(35)36)31-25(32-24)33-27-16-18(26)15-17-5-3-2-4-6-17/h2-16H,1H3,(H3,28,29,30,31,32,33)/b18-15-,27-16-InChIKey
DYMSKIOQUSMFDE-WCMHEWFTSA-NSynonyms
2N((Z)((Z)2BROMO3PHENYLPROP2ENYLIDENE)AMINO)4N(4METHOXYPHENYL)6N(4NITROPHENYL)135TRIAZINE246TRIAMINE
6((2Z)2((2Z)2bromo3phenylprop2en1ylidene)hydrazinyl)N(4methoxyphenyl)N(4nitrophenyl)135triazine24diamine
COC1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)(N+)(=O)(O))NN=CC(=CC4=CC=CC=C4)Br
COc1ccc(cc1)Nc1nc(NN=CC(=Cc2ccccc2)Br)nc(n1)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H21BrN8O3c1372213920(101422)29243023(281971121(12819)34(35)36)3125(3224)33271618(26)15175324617h216H1H3(H3282930313233)b18152716
MFCD00313500
ZINC000100028062
ZINC102772974
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