Vitas-M small molecule compound
2-{[(2Z)-4-methoxy-1,4-dioxo-1-(propan-2-ylamino)but-2-en-2-yl]amino}benzoic acid
Catalog ID
STK634453
SMILES COC(=O)/C=C(/C(=O)NC(C)C)\Nc1ccccc1C(=O)O
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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 C15H18N2O5 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5/c1-9(2)16-14(19)12(8-13(18)22-3)17-11-7-5-4-6-10(11)15(20)21/h4-9,17H,1-3H3,(H,16,19)(H,20,21)/b12-8-InChIKey
GOKIKEZTGJAFFU-WQLSENKSSA-NSynonyms
(E)2((1(isopropylamino)4methoxy14dioxobut2en2yl)amino)benzoicacid
2(((2Z)4methoxy14dioxo1(propan2ylamino)but2en2yl)amino)benzoicacid
2(((Z)4methoxy14dioxo1(propan2ylamino)but2en2yl)amino)benzoicacid
CC(C)NC(=O)C(=CC(=O)OC)NC1=CC=CC=C1C(=O)O
COC(=O)C=C(C(=O)NC(C)C)Nc1ccccc1C(=O)O
InChI=1SC15H18N2O5c19(2)1614(19)12(813(18)223)1711754610(11)15(20)21h4917H13H3(H1619)(H2021)b128
MFCD11070526
ZINC000021946166
ZINC21946166
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