Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL053371
SMILES CCOc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)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 C26H25N3O4 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4/c1-5-33-22-12-10-21(11-13-22)29-25(31)23(24(30)27-26(29)32)15-19-14-17(3)28(18(19)4)20-8-6-16(2)7-9-20/h6-15H,5H2,1-4H3,(H,27,30,32)/b23-15-InChIKey
RLSQUEGSYIDKHH-HAHDFKILSA-NSynonyms
358289-57-3(5Z)5((25dimethyl1(4methylphenyl)1Hpyrrol3yl)methylidene)3(4ethoxyphenyl)6hydroxypyrimidine24(3H5H)dione
(5Z)5((25DIMETHYL1(4METHYLPHENYL)PYRROL3YL)METHYLIDENE)1(4ETHOXYPHENYL)13DIAZINANE246TRIONE
358289573
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)C)C)C(=O)NC2=O
CCOc1ccc(cc1)N1C(=O)N=C(C(=Cc2cc(n(c2C)c2ccc(cc2)C)C)C1=O)O
InChI=1SC26H25N3O4c153322121021(111322)2925(31)23(24(30)2726(29)32)15191417(3)28(18(19)4)208616(2)7920h615H5H214H3(H273032)b2315
MFCD05734527
ZINC000009424192
ZINC09424192
ZINC9424192
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