Vitas-M small molecule compound
4-[4-hydroxy-7-(propan-2-yl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]phenyl 4-chlorobenzoate
Catalog ID
STK384391
SMILES Clc1ccc(cc1)C(=O)Oc1ccc(cc1)C1N=C(O)c2c(N1)sc1c2CCN(C1)C(C)C
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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 C25H24ClN3O3S MW 482.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3S/c1-14(2)29-12-11-19-20(13-29)33-24-21(19)23(30)27-22(28-24)15-5-9-18(10-6-15)32-25(31)16-3-7-17(26)8-4-16/h3-10,14,22,28H,11-13H2,1-2H3,(H,27,30)InChIKey
UCYOKFYGUZOXBZ-UHFFFAOYSA-NSynonyms
(4(4oxo7propan2yl123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)4chlorobenzoate
4(4hydroxy7(propan2yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)phenyl4chlorobenzoate
CC(C)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)Cl
InChI=1SC25H24ClN3O3Sc114(2)2912111920(1329)332421(19)23(30)2722(2824)155918(10615)3225(31)163717(26)8416h310142228H1113H212H3(H2730)
MFCD04041576
ZINC000008923469
ZINC000008923472
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