Vitas-M small molecule compound

(2E)-2-cyano-3-[2-(2,4-dichlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(3-methoxypropyl)prop-2-enamide

Catalog ID
STK706101
SMILES COCCCNC(=O)/C(=C/c1c(Oc2ccc(cc2Cl)Cl)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 C23H20Cl2N4O4 MW 487.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20Cl2N4O4/c1-14-5-3-9-29-20(14)28-22(33-19-7-6-16(24)12-18(19)25)17(23(29)31)11-15(13-26)21(30)27-8-4-10-32-2/h3,5-7,9,11-12H,4,8,10H2,1-2H3,(H,27,30)/b15-11+
InChIKey
BRSVTANMWGCYNX-RVDMUPIBSA-N
Synonyms
620538-09-2
(2E)2cyano3(2(24dichlorophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3methoxypropyl)prop2enamide
(E)2cyano3(2(24dichlorophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3methoxypropyl)acrylamide
(E)2CYANO3(2(24DICHLOROPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)N(3METHOXYPROPYL)PROP2ENAMIDE
620538092
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)OC3=C(C=C(C=C3)Cl)Cl
COCCCNC(=O)C(=Cc1c(Oc2ccc(cc2Cl)Cl)nc2n(c1=O)cccc2C)C#N
InChI=1SC23H20Cl2N4O4c1145392920(14)2822(33197616(24)1218(19)25)17(23(29)31)1115(1326)21(30)278410322h35791112H4810H212H3(H2730)b1511+
MFCD04447442
ZINC000009346124
ZINC9346124

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Available files

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