Vitas-M small molecule compound
(2E)-3-[2-(4-bromophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide
Catalog ID
STK800113
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2)/C(=O)Nc1ccccc1C
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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 C25H17BrN4O3 MW 501.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrN4O3/c1-16-6-2-3-7-21(16)28-23(31)17(15-27)14-20-24(33-19-11-9-18(26)10-12-19)29-22-8-4-5-13-30(22)25(20)32/h2-14H,1H3,(H,28,31)/b17-14+InChIKey
QODBWWQCFQRWRC-SAPNQHFASA-NSynonyms
(2E)3(2(4bromophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(2methylphenyl)prop2enamide
(E)3(2(4bromophenoxy)4oxopyrido(12a)pyrimidin3yl)2cyanoN(2methylphenyl)prop2enamide
CC1=CC=CC=C1NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)Br)C#N
InChI=1SC25H17BrN4O3c116623721(16)2823(31)17(1527)142024(331911918(26)101219)29228451330(22)25(20)32h214H1H3(H2831)b1714+
MFCD04447068
N#CC(=Cc1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2)C(=O)Nc1ccccc1C
ZINC000016735497
ZINC16735497
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