Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[{[2-(1H-indol-3-yl)ethyl]amino}(4-methoxyphenyl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440982
SMILES COc1ccc(cc1)/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)/NCCc1c[nH]c2c1cccc2
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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 C28H23BrN4O4 MW 559.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23BrN4O4/c1-37-21-12-6-17(7-13-21)25(30-15-14-18-16-31-23-5-3-2-4-22(18)23)24-26(34)32-28(36)33(27(24)35)20-10-8-19(29)9-11-20/h2-13,16,30-31H,14-15H2,1H3,(H,32,34,36)/b25-24+InChIKey
FNZNINQJUUJEJA-OCOZRVBESA-NSynonyms
6119-13-7(5E)1(4bromophenyl)5(((2(1Hindol3yl)ethyl)amino)(4methoxyphenyl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1(4BROMOPHENYL)5((2(1HINDOL3YL)ETHYLAMINO)(4METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
6119137
COC1=CC=C(C=C1)C(=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)NCCC4=CNC5=CC=CC=C54
COc1ccc(cc1)C(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)NCCc1c(nH)c2c1cccc2
InChI=1SC28H23BrN4O4c1372112617(71321)25(30151418163123532422(18)23)2426(34)3228(36)33(27(24)35)2010819(29)91120h213163031H1415H21H3(H323436)b2524+
MFCD06241070
ZINC000101380790
ZINC101380790
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