Vitas-M small molecule compound

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

Catalog ID
STK712629
SMILES Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2cccc(c2)C)/C1=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 C28H22FN3O4 MW 483.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22FN3O4/c1-18-5-4-6-22(15-18)36-14-13-31-17-19(23-7-2-3-8-25(23)31)16-24-26(33)30-28(35)32(27(24)34)21-11-9-20(29)10-12-21/h2-12,15-17H,13-14H2,1H3,(H,30,33,35)/b24-16-
InChIKey
GUJVZZOFNUGDKG-JLPGSUDCSA-N
Synonyms
799825-17-5
(5Z)1(4fluorophenyl)5((1(2(3methylphenoxy)ethyl)1Hindol3yl)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4FLUOROPHENYL)5((1(2(3METHYLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(4fluorophenyl)5((1(2(mtolyloxy)ethyl)1Hindol3yl)methylene)pyrimidine246(1H3H5H)trione
799825175
CC1=CC(=CC=C1)OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)F
Fc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)CCOc2cccc(c2)C)C1=O
InChI=1SC28H22FN3O4c11854622(1518)361413311719(23723825(23)31)162426(33)3028(35)32(27(24)34)2111920(29)101221h2121517H1314H21H3(H303335)b2416
MFCD03682961
ZINC000002238650
ZINC02238650
ZINC13570673
ZINC2238650

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.