Vitas-M small molecule compound
(5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK596076
SMILES O=C1N=C(O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C(=O)N1CCc1ccccc1
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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 C29H27N3O3 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3/c33-27-25(28(34)32(29(35)30-27)17-15-21-8-3-1-4-9-21)19-23-13-14-26-24(18-23)12-7-16-31(26)20-22-10-5-2-6-11-22/h1-6,8-11,13-14,18-19H,7,12,15-17,20H2,(H,30,33,35)/b25-19+InChIKey
XSXYIXHQEVURIG-NCELDCMTSA-NSynonyms
841209-40-3(5E)5((1benzyl1234tetrahydroquinolin6yl)methylidene)6hydroxy3(2phenylethyl)pyrimidine24(3H5H)dione
(5E)5((1benzyl34dihydro2Hquinolin6yl)methylidene)1(2phenylethyl)13diazinane246trione
(5E)5((1BENZYL34DIHYDRO2HQUINOLIN6YL)METHYLIDENE)1PHENETHYL13DIAZINANE246TRIONE
841209403
C1CC2=C(C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4)N(C1)CC5=CC=CC=C5
InChI=1SC29H27N3O3c332725(28(34)32(29(35)3027)1715218314921)192313142624(1823)1271631(26)2022105261122h1681113141819H712151720H2(H303335)b2519+
MFCD07210676
O=C1N=C(O)C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C(=O)N1CCc1ccccc1
ZINC000009015906
ZINC09015906
ZINC9015906
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