Vitas-M small molecule compound
tetraethyl 2,2'-[6-(phenylamino)-1,3,5-triazine-2,4-diyl]bis(nitropropanedioate)
Catalog ID
STK046182
SMILES CCOC(=O)C(c1nc(Nc2ccccc2)nc(n1)C(C(=O)OCC)(C(=O)OCC)[N+](=O)[O-])(C(=O)OCC)[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 C23H26N6O12 MW 578.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N6O12/c1-5-38-17(30)22(28(34)35,18(31)39-6-2)15-25-16(27-21(26-15)24-14-12-10-9-11-13-14)23(29(36)37,19(32)40-7-3)20(33)41-8-4/h9-13H,5-8H2,1-4H3,(H,24,25,26,27)InChIKey
WJHQWHOOYGRNFX-UHFFFAOYSA-NSynonyms
CCOC(=O)C(C1=NC(=NC(=N1)NC2=CC=CC=C2)C(C(=O)OCC)(C(=O)OCC)(N+)(=O)(O))(C(=O)OCC)(N+)(=O)(O)
CCOC(=O)C(c1nc(Nc2ccccc2)nc(n1)C(C(=O)OCC)(C(=O)OCC)(N+)(=O)(O))(C(=O)OCC)(N+)(=O)(O)
DIETHYL2(4ANILINO6(13DIETHOXY2NITRO13DIOXOPROPAN2YL)135TRIAZIN2YL)2NITROPROPANEDIOATE
InChI=1SC23H26N6O12c153817(30)22(28(34)3518(31)3962)152516(2721(2615)241412109111314)23(29(36)3719(32)4073)20(33)4184h913H58H214H3(H24252627)
MFCD00312234
STK046182
TETRAETHYL22(6(PHENYLAMINO)135TRIAZINE24DIYL)BIS(NITROPROPANEDIOATE)
ZINC000068572849
ZINC68572849
Check stock
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Check stock on Vitas-MAvailable files
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