Vitas-M small molecule compound
ethyl 4-[5-(morpholin-4-yl)-8-oxo-1,3,4,8-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-9(2H)-yl]benzoate
Catalog ID
STK549066
SMILES CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1
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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 C26H26N4O4S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S/c1-2-34-26(32)16-7-9-17(10-8-16)30-15-27-21-20-18-5-3-4-6-19(18)23(29-11-13-33-14-12-29)28-24(20)35-22(21)25(30)31/h7-10,15H,2-6,11-14H2,1H3InChIKey
UTKLFACNLKSOLY-UHFFFAOYSA-NSynonyms
799778-19-1799778191
CCOC(=O)C1=CC=C(C=C1)N2C=NC3=C(C2=O)SC4=NC(=C5CCCCC5=C34)N6CCOCC6
ethyl4(5(morpholin4yl)8oxo1348tetrahydropyrimido(4545)thieno(23c)isoquinolin9(2H)yl)benzoate
ethyl4(5morpholino8oxo1234tetrahydropyrimido(4545)thieno(23c)isoquinolin9(8H)yl)benzoate
InChI=1SC26H26N4O4Sc123426(32)167917(10816)301527212018534619(18)23(29111333141229)2824(20)3522(21)25(30)31h71015H261114H21H3
MFCD03673436
ZINC000020171029
ZINC20171029
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