Vitas-M small molecule compound
ethyl 2-(4-{[(2E)-3-(furan-2-yl)prop-2-enoyl]oxy}phenyl)-4-oxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK381864
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1)OC(=O)/C=C/c1ccco1
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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 C25H23N3O6S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6S/c1-2-32-25(31)28-12-11-18-19(14-28)35-24-21(18)23(30)26-22(27-24)15-5-7-17(8-6-15)34-20(29)10-9-16-4-3-13-33-16/h3-10,13,22,27H,2,11-12,14H2,1H3,(H,26,30)/b10-9+InChIKey
KNVHRXWNWOMEJD-MDZDMXLPSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C=CC5=CC=CO5
CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1)OC(=O)C=Cc1ccco1
ethyl2(4(((2E)3(furan2yl)prop2enoyl)oxy)phenyl)4oxo134568hexahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(4((E)3(furan2yl)prop2enoyl)oxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC25H23N3O6Sc123225(31)2812111819(1428)352421(18)23(30)2622(2724)155717(8615)3420(29)1091643133316h310132227H2111214H21H3(H2630)b109+
MFCD02604398
ZINC000008722157
ZINC000008722158
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