Vitas-M small molecule compound

(5Z)-5-({1-[2-(4-chloro-2-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-3-(4-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STL150696
SMILES Fc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2C)Cl)/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 C28H21ClFN3O4 MW 517.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClFN3O4/c1-17-14-19(29)6-11-25(17)37-13-12-32-16-18(22-4-2-3-5-24(22)32)15-23-26(34)31-28(36)33(27(23)35)21-9-7-20(30)8-10-21/h2-11,14-16H,12-13H2,1H3,(H,31,34,36)/b23-15-
InChIKey
QZHYSHBHRQBJEL-HAHDFKILSA-N
Synonyms
585550-41-0
(5Z)5((1(2(4chloro2methylphenoxy)ethyl)1Hindol3yl)methylidene)3(4fluorophenyl)6hydroxypyrimidine24(3H5H)dione
(5Z)5((1(2(4CHLORO2METHYLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)1(4FLUOROPHENYL)13DIAZINANE246TRIONE
585550410
CC1=C(C=CC(=C1)Cl)OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)F
Fc1ccc(cc1)N1C(=O)N=C(C(=Cc2cn(c3c2cccc3)CCOc2ccc(cc2C)Cl)C1=O)O
InChI=1SC28H21ClFN3O4c1171419(29)61125(17)371312321618(22423524(22)32)152326(34)3128(36)33(27(23)35)219720(30)81021h2111416H1213H21H3(H313436)b2315
MFCD04082120
ZINC000001256324
ZINC01256324
ZINC1256324
ZINC13750452

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Available files

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