Vitas-M small molecule compound
methyl 2-({2-[(1,3-benzodioxol-5-ylmethyl)amino]-3,4-dioxocyclobut-1-en-1-yl}amino)benzoate
Catalog ID
STL408567
SMILES COC(=O)c1ccccc1NC1=C(C(=O)C1=O)NCc1ccc2c(c1)OCO2
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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 C20H16N2O6 MW 380.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O6/c1-26-20(25)12-4-2-3-5-13(12)22-17-16(18(23)19(17)24)21-9-11-6-7-14-15(8-11)28-10-27-14/h2-8,21-22H,9-10H2,1H3InChIKey
ZFOBUAZBEUWCEZ-UHFFFAOYSA-NSynonyms
1574339-40-41574339404
COC(=O)C1=CC=CC=C1NC2=C(C(=O)C2=O)NCC3=CC4=C(C=C3)OCO4
InChI=1SC20H16N2O6c12620(25)12423513(12)221716(18(23)19(17)24)21911671415(811)28102714h282122H910H21H3
methyl2((2((13benzodioxol5ylmethyl)amino)34dioxocyclobut1en1yl)amino)benzoate
methyl2((2((benzo(d)(13)dioxol5ylmethyl)amino)34dioxocyclobut1en1yl)amino)benzoate
methyl2((2(13benzodioxol5ylmethylamino)34dioxocyclobuten1yl)amino)benzoate
MFCD28058412
ZINC000108452588
ZINC108452588
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