Vitas-M small molecule compound
(2E)-3-[2-(4-chloro-3-methylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(2-methoxyethyl)prop-2-enamide
Catalog ID
STK824081
SMILES COCCNC(=O)/C(=C/c1c(Oc2ccc(c(c2)C)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 C23H21ClN4O4 MW 452.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O4/c1-14-5-4-9-28-20(14)27-22(32-17-6-7-19(24)15(2)11-17)18(23(28)30)12-16(13-25)21(29)26-8-10-31-3/h4-7,9,11-12H,8,10H2,1-3H3,(H,26,29)/b16-12+InChIKey
XRTPTSHQEADJNV-FOWTUZBSSA-NSynonyms
620536-86-9(2E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(2methoxyethyl)prop2enamide
(E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(2methoxyethyl)acrylamide
(E)3(2(4CHLORO3METHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANON(2METHOXYETHYL)PROP2ENAMIDE
620536869
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCOC)OC3=CC(=C(C=C3)Cl)C
COCCNC(=O)C(=Cc1c(Oc2ccc(c(c2)C)Cl)nc2n(c1=O)cccc2C)C#N
InChI=1SC23H21ClN4O4c1145492820(14)2722(32176719(24)15(2)1117)18(23(28)30)1216(1325)21(29)26810313h4791112H810H213H3(H2629)b1612+
MFCD04162928
ZINC000002409582
ZINC2409582
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