Vitas-M small molecule compound
(5E)-5-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STL040215
SMILES Clc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)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 C25H18ClN3O4 MW 459.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O4/c26-18-9-7-16(8-10-18)13-28-14-17(20-5-1-2-6-22(20)28)12-21-23(30)27-25(32)29(24(21)31)15-19-4-3-11-33-19/h1-12,14H,13,15H2,(H,27,30,32)/b21-12+InChIKey
ZNBMWPYADCBZSN-CIAFOILYSA-NSynonyms
345336-70-1(5E)5((1((4CHLOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)1(FURAN2YLMETHYL)13DIAZINANE246TRIONE
(5E)5((1(4chlorobenzyl)1Hindol3yl)methylidene)3(furan2ylmethyl)6hydroxypyrimidine24(3H5H)dione
345336701
C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)Cl)C=C4C(=O)NC(=O)N(C4=O)CC5=CC=CO5
Clc1ccc(cc1)Cn1cc(c2c1cccc2)C=C1C(=NC(=O)N(C1=O)Cc1ccco1)O
InChI=1SC25H18ClN3O4c26189716(81018)13281417(20512622(20)28)122123(30)2725(32)29(24(21)31)151943113319h11214H1315H2(H273032)b2112+
MFCD03814154
ZINC000013536976
ZINC13536976
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