Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[{[2-(5-fluoro-1H-indol-3-yl)ethyl]amino}(phenyl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440751
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccccc2)\NCCc2c[nH]c3c2cc(F)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 C27H20BrFN4O3 MW 547.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20BrFN4O3/c28-18-6-9-20(10-7-18)33-26(35)23(25(34)32-27(33)36)24(16-4-2-1-3-5-16)30-13-12-17-15-31-22-11-8-19(29)14-21(17)22/h1-11,14-15,30-31H,12-13H2,(H,32,34,36)/b24-23+InChIKey
LNQMDPDQIHYWKX-WCWDXBQESA-NSynonyms
(5E)1(4bromophenyl)5(((2(5fluoro1Hindol3yl)ethyl)amino)(phenyl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1(4BROMOPHENYL)5((2(5FLUORO1HINDOL3YL)ETHYLAMINO)PHENYLMETHYLIDENE)13DIAZINANE246TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccccc2)NCCc2c(nH)c3c2cc(F)cc3)C1=O
C1=CC=C(C=C1)C(=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)NCCC4=CNC5=C4C=C(C=C5)F
InChI=1SC27H20BrFN4O3c28186920(10718)3326(35)23(25(34)3227(33)36)24(164213516)3013121715312211819(29)1421(17)22h11114153031H1213H2(H323436)b2423+
MFCD06240880
ZINC000003767787
ZINC3767787
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