Vitas-M small molecule compound
(2E)-2-cyano-N-(3-ethoxypropyl)-3-[2-(4-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Catalog ID
STK800376
SMILES CCOCCCNC(=O)/C(=C/c1c(Oc2ccc(cc2)OC)nc2n(c1=O)cccc2C)/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 C25H26N4O5 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5/c1-4-33-14-6-12-27-23(30)18(16-26)15-21-24(34-20-10-8-19(32-3)9-11-20)28-22-17(2)7-5-13-29(22)25(21)31/h5,7-11,13,15H,4,6,12,14H2,1-3H3,(H,27,30)/b18-15+InChIKey
PPCMQYQLCCDRNV-OBGWFSINSA-NSynonyms
620112-23-4(2E)2cyanoN(3ethoxypropyl)3(2(4methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyanoN(3ethoxypropyl)3(2(4methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)acrylamide
(E)2CYANON(3ETHOXYPROPYL)3(2(4METHOXYPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
620112234
CCOCCCNC(=O)C(=CC1=C(N=C2C(=CC=CN2C1=O)C)OC3=CC=C(C=C3)OC)C#N
CCOCCCNC(=O)C(=Cc1c(Oc2ccc(cc2)OC)nc2n(c1=O)cccc2C)C#N
InChI=1SC25H26N4O5c1433146122723(30)18(1626)152124(342010819(323)91120)282217(2)751329(22)25(21)31h57111315H461214H213H3(H2730)b1815+
MFCD04158956
ZINC000003644136
ZINC3644136
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