Vitas-M small molecule compound
(2E)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STL200813
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2C)/c1nc2c(n1C)cccc2
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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 C26H18BrN5O2 MW 512.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18BrN5O2/c1-16-6-5-13-32-23(16)30-25(34-19-11-9-18(27)10-12-19)20(26(32)33)14-17(15-28)24-29-21-7-3-4-8-22(21)31(24)2/h3-14H,1-2H3/b17-14+InChIKey
NFIYJIAKFPUOQD-SAPNQHFASA-NSynonyms
620111-54-8(2E)3(2(4bromophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(1methyl1Hbenzimidazol2yl)prop2enenitrile
(E)3(2(4bromophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(1methyl1Hbenzo(d)imidazol2yl)acrylonitrile
(E)3(2(4BROMOPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2(1METHYLBENZIMIDAZOL2YL)PROP2ENENITRILE
620111548
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C3=NC4=CC=CC=C4N3C)OC5=CC=C(C=C5)Br
InChI=1SC26H18BrN5O2c11665133223(16)3025(341911918(27)101219)20(26(32)33)1417(1528)242921734822(21)31(24)2h314H12H3b1714+
MFCD04447685
N#CC(=Cc1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2C)c1nc2c(n1C)cccc2
ZINC000008606333
ZINC8606333
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