Vitas-M small molecule compound
methyl 2-({2-[(3,4-dimethoxybenzyl)amino]-3,4-dioxocyclobut-1-en-1-yl}amino)benzoate
Catalog ID
STL410034
SMILES COC(=O)c1ccccc1NC1=C(C(=O)C1=O)NCc1ccc(c(c1)OC)OC
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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 C21H20N2O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6/c1-27-15-9-8-12(10-16(15)28-2)11-22-17-18(20(25)19(17)24)23-14-7-5-4-6-13(14)21(26)29-3/h4-10,22-23H,11H2,1-3H3InChIKey
DZCUTAZZYVIUGF-UHFFFAOYSA-NSynonyms
1574528-17-81574528178
COC1=C(C=C(C=C1)CNC2=C(C(=O)C2=O)NC3=CC=CC=C3C(=O)OC)OC
InChI=1SC21H20N2O6c127159812(1016(15)282)11221718(20(25)19(17)24)2314754613(14)21(26)293h4102223H11H213H3
methyl2((2((34dimethoxybenzyl)amino)34dioxocyclobut1en1yl)amino)benzoate
methyl2((2((34dimethoxyphenyl)methylamino)34dioxocyclobuten1yl)amino)benzoate
MFCD28059396
ZINC000108454791
ZINC108454791
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