Vitas-M small molecule compound
4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl 2,4-dichlorobenzoate
Catalog ID
STK746097
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1Cl)Cl)C1N=C(O)c2c(N1)sc1c2CCN(C1)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 C24H21Cl2N3O4S MW 518.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2N3O4S/c1-29-8-7-15-19(11-29)34-23-20(15)22(30)27-21(28-23)12-3-6-17(18(9-12)32-2)33-24(31)14-5-4-13(25)10-16(14)26/h3-6,9-10,21,28H,7-8,11H2,1-2H3,(H,27,30)InChIKey
ISDGJVTYLLHYHE-UHFFFAOYSA-NSynonyms
489417-01-8(2methoxy4(7methyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)24dichlorobenzoate
4(4hydroxy7methyl125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)2methoxyphenyl24dichlorobenzoate
489417018
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C=C4)OC(=O)C5=C(C=C(C=C5)Cl)Cl)OC
InChI=1SC24H21Cl2N3O4Sc129871519(1129)342320(15)22(30)2721(2823)123617(18(912)322)3324(31)145413(25)1016(14)26h369102128H7811H212H3(H2730)
MFCD03812620
ZINC000009272686
ZINC000009272687
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