Vitas-M small molecule compound
4-(7-ethyl-4-hydroxy-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl 4-bromobenzoate
Catalog ID
STK384593
SMILES CCN1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Br)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 C25H24BrN3O4S MW 542.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O4S/c1-3-29-11-10-17-20(13-29)34-24-21(17)23(30)27-22(28-24)15-6-9-18(19(12-15)32-2)33-25(31)14-4-7-16(26)8-5-14/h4-9,12,22,28H,3,10-11,13H2,1-2H3,(H,27,30)InChIKey
XYWXOMDWPDAYOM-UHFFFAOYSA-NSynonyms
(4(7ethyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)2methoxyphenyl)4bromobenzoate
4(7ethyl4hydroxy125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)2methoxyphenyl4bromobenzoate
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OC(=O)C5=CC=C(C=C5)Br)OC
InChI=1SC25H24BrN3O4Sc132911101720(1329)342421(17)23(30)2722(2824)156918(19(1215)322)3325(31)144716(26)8514h49122228H3101113H212H3(H2730)
MFCD04966699
ZINC000102099484
ZINC000102099488
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