Vitas-M small molecule compound
(2E)-2-cyano-N-(3-methoxypropyl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Catalog ID
STL239036
SMILES COCCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCN(CC1)C)/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 C22H28N6O3 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O3/c1-16-6-4-8-28-19(16)25-20(27-11-9-26(2)10-12-27)18(22(28)30)14-17(15-23)21(29)24-7-5-13-31-3/h4,6,8,14H,5,7,9-13H2,1-3H3,(H,24,29)/b17-14+InChIKey
BAAVJPWQPNBZNX-SAPNQHFASA-NSynonyms
796881-79-3(2E)2cyanoN(3methoxypropyl)3(9methyl2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyanoN(3methoxypropyl)3(9methyl2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)acrylamide
(E)2CYANON(3METHOXYPROPYL)3(9METHYL2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
796881793
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)N3CCN(CC3)C
COCCCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCN(CC1)C)C#N
InChI=1SC22H28N6O3c1166482819(16)2520(2711926(2)101227)18(22(28)30)1417(1523)21(29)247513313h46814H57913H213H3(H2429)b1714+
MFCD03670737
ZINC000002202560
ZINC2202560
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