Vitas-M small molecule compound
(2E)-2-cyano-N-(3-methoxypropyl)-3-[9-methyl-4-oxo-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Catalog ID
STK881422
SMILES COCCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccccc1)/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 C27H30N6O3 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N6O3/c1-20-8-6-12-33-24(20)30-25(32-15-13-31(14-16-32)22-9-4-3-5-10-22)23(27(33)35)18-21(19-28)26(34)29-11-7-17-36-2/h3-6,8-10,12,18H,7,11,13-17H2,1-2H3,(H,29,34)/b21-18+InChIKey
MJQYTNMSCPXLMS-DYTRJAOYSA-NSynonyms
799773-22-1(2E)2cyanoN(3methoxypropyl)3(9methyl4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyanoN(3methoxypropyl)3(9methyl4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)acrylamide
(E)2CYANON(3METHOXYPROPYL)3(9METHYL4OXO2(4PHENYLPIPERAZIN1YL)PYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
799773221
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)N3CCN(CC3)C4=CC=CC=C4
COCCCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccccc1)C#N
InChI=1SC27H30N6O3c12086123324(20)3025(32151331(141632)2294351022)23(27(33)35)1821(1928)26(34)2911717362h368101218H7111317H212H3(H2934)b2118+
MFCD03672542
ZINC000009075688
ZINC9075688
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.