Vitas-M small molecule compound
(4E)-4-({[2-(furan-2-yl)-2-(morpholin-4-yl)ethyl]amino}methylidene)-2-(3-methoxyphenyl)isoquinoline-1,3(2H,4H)-dione
Catalog ID
STL237918
SMILES COc1cccc(c1)N1C(=O)/C(=C/NCC(c2ccco2)N2CCOCC2)/c2c(C1=O)cccc2
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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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-33-20-7-4-6-19(16-20)30-26(31)22-9-3-2-8-21(22)23(27(30)32)17-28-18-24(25-10-5-13-35-25)29-11-14-34-15-12-29/h2-10,13,16-17,24,28H,11-12,14-15,18H2,1H3/b23-17+InChIKey
SDTDLLIXMUUOGD-HAVVHWLPSA-NSynonyms
(4E)4(((2(furan2yl)2(morpholin4yl)ethyl)amino)methylidene)2(3methoxyphenyl)isoquinoline13(2H4H)dione
(4E)4(((2(furan2yl)2morpholin4ylethyl)amino)methylidene)2(3methoxyphenyl)isoquinoline13dione
(E)4(((2(furan2yl)2morpholinoethyl)amino)methylene)2(3methoxyphenyl)isoquinoline13(2H4H)dione
COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=CNCC(C4=CC=CO4)N5CCOCC5)C2=O
COc1cccc(c1)N1C(=O)C(=CNCC(c2ccco2)N2CCOCC2)c2c(C1=O)cccc2
InChI=1SC27H27N3O5c1332074619(1620)3026(31)22932821(22)23(27(30)32)17281824(25105133525)29111434151229h2101316172428H1112141518H21H3b2317+
MFCD09858300
ZINC000020675629
ZINC000020675633
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