Vitas-M small molecule compound
4-methoxybenzyl (2E)-2-[4-(1,3-benzodioxol-5-ylamino)-4-oxobutan-2-ylidene]hydrazinecarboxylate
Catalog ID
STK114807
SMILES COc1ccc(cc1)COC(=O)N/N=C(/CC(=O)Nc1ccc2c(c1)OCO2)\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 C20H21N3O6 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6/c1-13(9-19(24)21-15-5-8-17-18(10-15)29-12-28-17)22-23-20(25)27-11-14-3-6-16(26-2)7-4-14/h3-8,10H,9,11-12H2,1-2H3,(H,21,24)(H,23,25)/b22-13+InChIKey
WAPAQNSHBNFZSU-LPYMAVHISA-NSynonyms
497247-50-4(4methoxyphenyl)methylN((E)(4(13benzodioxol5ylamino)4oxobutan2ylidene)amino)carbamate
(E)4methoxybenzyl2(4(benzo(d)(13)dioxol5ylamino)4oxobutan2ylidene)hydrazinecarboxylate
497247504
4METHOXYBENZYL(2E)2(4(13BENZODIOXOL5YLAMINO)4OXOBUTAN2YLIDENE)HYDRAZINECARBOXYLATE
CC(=NNC(=O)OCC1=CC=C(C=C1)OC)CC(=O)NC2=CC3=C(C=C2)OCO3
COc1ccc(cc1)COC(=O)NN=C(CC(=O)Nc1ccc2c(c1)OCO2)C
InChI=1SC20H21N3O6c113(919(24)2115581718(1015)29122817)222320(25)2711143616(262)7414h3810H91112H212H3(H2124)(H2325)b2213+
MFCD00494995
ZINC000100751879
ZINC101533170
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