Vitas-M small molecule compound
2-methoxy-4-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl 4-fluorobenzoate
Catalog ID
STK076474
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1)F)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C24H19FN2O4S MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19FN2O4S/c1-30-18-12-14(8-11-17(18)31-24(29)13-6-9-15(25)10-7-13)21-26-22(28)20-16-4-2-3-5-19(16)32-23(20)27-21/h6-12H,2-5H2,1H3,(H,26,27,28)InChIKey
IEWTXTXHNMZJCQ-UHFFFAOYSA-NSynonyms
(2methoxy4(4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)phenyl)4fluorobenzoate
2methoxy4(4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)phenyl4fluorobenzoate
COC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OC(=O)C5=CC=C(C=C5)F
COc1cc(ccc1OC(=O)c1ccc(cc1)F)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC24H19FN2O4Sc130181214(81117(18)3124(29)136915(25)10713)212622(28)2016423519(16)3223(20)2721h612H25H21H3(H262728)
MFCD03135511
STK076474
ZINC000001171456
ZINC01171456
ZINC1171456
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