Vitas-M small molecule compound
N'-benzyl-N,N-dimethyl-6-{(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazine-2,4-diamine
Catalog ID
STL380093
SMILES CN(c1nc(N/N=C/c2cc3OCOc3cc2[N+](=O)[O-])nc(n1)NCc1ccccc1)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 C20H20N8O4 MW 436.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N8O4/c1-27(2)20-24-18(21-10-13-6-4-3-5-7-13)23-19(25-20)26-22-11-14-8-16-17(32-12-31-16)9-15(14)28(29)30/h3-9,11H,10,12H2,1-2H3,(H2,21,23,24,25,26)/b22-11+InChIKey
LZTOOGYKAGUULH-SSDVNMTOSA-NSynonyms
(4(((1E)2(6NITRO(2HBENZO(D)13DIOXOLAN5YL))1AZAVINYL)AMINO)6(BENZYLAMINO)(135TRIAZIN2YL))DIMETHYLAMINE
6Nbenzyl2N2Ndimethyl4N((E)(6nitro13benzodioxol5yl)methylideneamino)135triazine246triamine
CN(C)C1=NC(=NC(=N1)NN=CC2=CC3=C(C=C2(N+)(=O)(O))OCO3)NCC4=CC=CC=C4
CN(c1nc(NN=Cc2cc3OCOc3cc2(N+)(=O)(O))nc(n1)NCc1ccccc1)C
InChI=1SC20H20N8O4c127(2)202418(2110136435713)2319(2520)2622111481617(32123116)915(14)28(29)30h3911H1012H212H3(H22123242526)b2211+
MFCD01242016
NbenzylNNdimethyl6((2E)2((6nitro13benzodioxol5yl)methylidene)hydrazinyl)135triazine24diamine
ZINC000016186630
ZINC34871260
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