Vitas-M small molecule compound
tetra-tert-butyl 2,2'-[6-(propan-2-ylamino)-1,3,5-triazine-2,4-diyl]bis(nitropropanedioate)
Catalog ID
STK036736
SMILES CC(Nc1nc(nc(n1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[N+](=O)[O-])C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[N+](=O)[O-])C
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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 C28H44N6O12 MW 656.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H44N6O12/c1-15(2)29-22-31-16(27(33(39)40,18(35)43-23(3,4)5)19(36)44-24(6,7)8)30-17(32-22)28(34(41)42,20(37)45-25(9,10)11)21(38)46-26(12,13)14/h15H,1-14H3,(H,29,30,31,32)InChIKey
JGEWQIFUXHSEQD-UHFFFAOYSA-NSynonyms
CC(C)NC1=NC(=NC(=N1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)(N+)(=O)(O))C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)(N+)(=O)(O)
CC(Nc1nc(nc(n1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)(N+)(=O)(O))C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)(N+)(=O)(O))C
DITERTBUTYL2(4(13BIS((2METHYLPROPAN2YL)OXY)2NITRO13DIOXOPROPAN2YL)6(PROPAN2YLAMINO)135TRIAZIN2YL)2NITROPROPANEDIOATE
InChI=1SC28H44N6O12c115(2)29223116(27(33(39)4018(35)4323(34)5)19(36)4424(67)8)3017(3222)28(34(41)4220(37)4525(910)11)21(38)4626(1213)14h15H114H3(H29303132)
MFCD03731006
STK036736
TETRATERTBUTYL22(6(PROPAN2YLAMINO)135TRIAZINE24DIYL)BIS(NITROPROPANEDIOATE)
ZINC000150445250
ZINC150445250
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.