Vitas-M small molecule compound
4-{[(2E)-1-(cyclohexylamino)-4-methoxy-1,4-dioxobut-2-en-2-yl]amino}benzoic acid
Catalog ID
STK634362
SMILES COC(=O)/C=C(\C(=O)NC1CCCCC1)/Nc1ccc(cc1)C(=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 C18H22N2O5 MW 346.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O5/c1-25-16(21)11-15(17(22)20-13-5-3-2-4-6-13)19-14-9-7-12(8-10-14)18(23)24/h7-11,13,19H,2-6H2,1H3,(H,20,22)(H,23,24)/b15-11+InChIKey
PQLQPQGWALCPSD-RVDMUPIBSA-NSynonyms
931740-28-2(E)4((1(cyclohexylamino)4methoxy14dioxobut2en2yl)amino)benzoicacid
4(((2E)1(cyclohexylamino)4methoxy14dioxobut2en2yl)amino)benzoicacid
4(((E)1(cyclohexylamino)4methoxy14dioxobut2en2yl)amino)benzoicacid
931740282
COC(=O)C=C(C(=O)NC1CCCCC1)Nc1ccc(cc1)C(=O)O
COC(=O)C=C(C(=O)NC1CCCCC1)NC2=CC=C(C=C2)C(=O)O
InChI=1SC18H22N2O5c12516(21)1115(17(22)20135324613)19149712(81014)18(23)24h7111319H26H21H3(H2022)(H2324)b1511+
MFCD12202550
ZINC000012324576
ZINC12324576
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