Vitas-M small molecule compound
(2E)-3-[2-(4-benzylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(3-methoxypropyl)prop-2-enamide
Catalog ID
STK881412
SMILES COCCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCN(CC1)Cc1ccccc1)/C#N
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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 C28H32N6O3 MW 500.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N6O3/c1-21-8-6-12-34-25(21)31-26(33-15-13-32(14-16-33)20-22-9-4-3-5-10-22)24(28(34)36)18-23(19-29)27(35)30-11-7-17-37-2/h3-6,8-10,12,18H,7,11,13-17,20H2,1-2H3,(H,30,35)/b23-18+InChIKey
VGXRNGYTOKOHMV-PTGBLXJZSA-NSynonyms
797799-62-3(2E)3(2(4benzylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(3methoxypropyl)prop2enamide
(E)3(2(4benzylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(3methoxypropyl)acrylamide
(E)3(2(4BENZYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANON(3METHOXYPROPYL)PROP2ENAMIDE
797799623
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)N3CCN(CC3)CC4=CC=CC=C4
COCCCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCN(CC1)Cc1ccccc1)C#N
InChI=1SC28H32N6O3c12186123425(21)3126(33151332(141633)202294351022)24(28(34)36)1823(1929)27(35)3011717372h368101218H711131720H212H3(H3035)b2318+
MFCD03668667
ZINC000013647881
ZINC13647881
Check stock
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Check stock on Vitas-MAvailable files
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