Vitas-M small molecule compound
N-(2-{[(1E)-1-(6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene)ethyl]amino}ethyl)-3-amino-1H-1,2,4-triazole-5-carboxamide
Catalog ID
STL546248
SMILES Nc1n[nH]c(n1)C(=O)NCCN/C(=C/1\C(=O)C=C2C(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)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 C23H24N6O7 MW 496.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N6O7/c1-8-16(32)14(10(3)30)18-15(17(8)33)23(4)12(36-18)7-11(31)13(19(23)34)9(2)25-5-6-26-21(35)20-27-22(24)29-28-20/h7,25,32-33H,5-6H2,1-4H3,(H,26,35)(H3,24,27,28,29)/b13-9+InChIKey
MAPPLUJYMIEPLE-UKTHLTGXSA-NSynonyms
(RE)N(2((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)ethyl)5amino1H124triazole3carboxamide
~(N)(2(((1~(E))1(6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)ethyl)3amino1~(H)124triazole5carboxamide
122170120
InChI=1SC23H24N6O7c1816(32)14(10(3)30)1815(17(8)33)23(4)12(3618)711(31)13(19(23)34)9(2)25562621(35)202722(24)292820h7253233H56H214H3(H2635)(H324272829)b139+
MFCD31756372
N(2(((1E)1(6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)amino)ethyl)3amino1H124triazole5carboxamide
Nc1(nH)nc(n1)C(=O)NCCNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000253409563
ZINC000409413885
Check stock
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