Vitas-M small molecule compound

(5E)-5-[{[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]amino}(phenyl)methylidene]-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL440952
SMILES Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccccc2)\NCCc2c(C)[nH]c3c2cc(Br)cc3)/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 C29H25BrN4O3 MW 557.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrN4O3/c1-17-8-11-21(12-9-17)34-28(36)25(27(35)33-29(34)37)26(19-6-4-3-5-7-19)31-15-14-22-18(2)32-24-13-10-20(30)16-23(22)24/h3-13,16,31-32H,14-15H2,1-2H3,(H,33,35,37)/b26-25+
InChIKey
KAXOJRYQZXCBLM-OCEACIFDSA-N
Synonyms

(5E)5(((2(5bromo2methyl1Hindol3yl)ethyl)amino)(phenyl)methylidene)1(4methylphenyl)pyrimidine246(1H3H5H)trione
(5E)5((2(5BROMO2METHYL1HINDOL3YL)ETHYLAMINO)PHENYLMETHYLIDENE)1(4METHYLPHENYL)13DIAZINANE246TRIONE
CC1=CC=C(C=C1)N2C(=O)C(=C(C3=CC=CC=C3)NCCC4=C(NC5=C4C=C(C=C5)Br)C)C(=O)NC2=O
Cc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccccc2)NCCc2c(C)(nH)c3c2cc(Br)cc3)C1=O
InChI=1SC29H25BrN4O3c11781121(12917)3428(36)25(27(35)3329(34)37)26(196435719)3115142218(2)3224131020(30)1623(22)24h313163132H1415H212H3(H333537)b2625+
MFCD06241039
ZINC000101380896
ZINC101380896

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Available files

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