Vitas-M small molecule compound

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

Catalog ID
STK026939
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2Cl)/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 C28H22ClN3O3 MW 483.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O3/c1-2-18-11-13-21(14-12-18)32-27(34)23(26(33)30-28(32)35)15-20-17-31(25-10-6-4-8-22(20)25)16-19-7-3-5-9-24(19)29/h3-15,17H,2,16H2,1H3,(H,30,33,35)/b23-15-
InChIKey
QSUIEGZNQZVEQS-HAHDFKILSA-N
Synonyms
672902-13-5
(5Z)5((1((2CHLOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5((1(2CHLOROBENZYL)1HINDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1(2CHLOROBENZYL)1HINDOL3YL)METHYLIDENE)3(4ETHYLPHENYL)6HYDROXYPYRIMIDINE24(3H5H)DIONE
(Z)5((1(2chlorobenzyl)1Hindol3yl)methylene)1(4ethylphenyl)pyrimidine246(1H3H5H)trione
672902135
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)Cc2ccccc2Cl)C1=O
InChI=1SC28H22ClN3O3c1218111321(141218)3227(34)23(26(33)3028(32)35)15201731(251064822(20)25)1619735924(19)29h31517H216H21H3(H303335)b2315
MFCD03681511
STK026939
ZINC09271748
ZINC18285084
ZINC9271748

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Available files

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