Vitas-M small molecule compound
ethyl 2-(2-bromo-5-hydroxyphenyl)-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK383958
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cc(O)ccc1Br)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 C18H18BrN3O4S MW 452.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O4S/c1-2-26-18(25)22-6-5-10-13(8-22)27-17-14(10)16(24)20-15(21-17)11-7-9(23)3-4-12(11)19/h3-4,7,15,21,23H,2,5-6,8H2,1H3,(H,20,24)InChIKey
KRDLOBBRKWHICZ-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC(=C4)O)Br
ethyl2(2bromo5hydroxyphenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(2bromo5hydroxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC18H18BrN3O4Sc122618(25)22651013(822)271714(10)16(24)2015(2117)1179(23)3412(11)19h347152123H2568H21H3(H2024)
MFCD03837032
ZINC000008920781
ZINC000008920784
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