Vitas-M small molecule compound
(2E)-2-cyano-3-[2-(dibenzylamino)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(2-methoxyethyl)prop-2-enamide
Catalog ID
STK881428
SMILES COCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N(Cc1ccccc1)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 C30H29N5O3 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O3/c1-22-10-9-16-35-27(22)33-28(26(30(35)37)18-25(19-31)29(36)32-15-17-38-2)34(20-23-11-5-3-6-12-23)21-24-13-7-4-8-14-24/h3-14,16,18H,15,17,20-21H2,1-2H3,(H,32,36)/b25-18+InChIKey
CGAJQHZWDLOPSP-XIEYBQDHSA-NSynonyms
799776-32-2(2E)2cyano3(2(dibenzylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(2methoxyethyl)prop2enamide
(E)2cyano3(2(dibenzylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(2methoxyethyl)acrylamide
(E)2CYANO3(2(DIBENZYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)N(2METHOXYETHYL)PROP2ENAMIDE
799776322
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCOC)N(CC3=CC=CC=C3)CC4=CC=CC=C4
COCCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N(Cc1ccccc1)Cc1ccccc1)C#N
InChI=1SC30H29N5O3c122109163527(22)3328(26(30(35)37)1825(1931)29(36)321517382)34(2023115361223)2124137481424h3141618H15172021H212H3(H3236)b2518+
MFCD03672810
ZINC000002207338
ZINC2207338
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.