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-(3-methoxypropyl)prop-2-enamide
Catalog ID
STK705533
SMILES COCCCNC(=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 C24H23ClN4O4 MW 466.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN4O4/c1-15-6-4-10-29-21(15)28-23(33-18-7-8-20(25)16(2)12-18)19(24(29)31)13-17(14-26)22(30)27-9-5-11-32-3/h4,6-8,10,12-13H,5,9,11H2,1-3H3,(H,27,30)/b17-13+InChIKey
TXMQGTHDVHRWAE-GHRIWEEISA-NSynonyms
620536-85-8(2E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(3methoxypropyl)prop2enamide
(E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(3methoxypropyl)acrylamide
(E)3(2(4CHLORO3METHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANON(3METHOXYPROPYL)PROP2ENAMIDE
620536858
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)OC3=CC(=C(C=C3)Cl)C
COCCCNC(=O)C(=Cc1c(Oc2ccc(c(c2)C)Cl)nc2n(c1=O)cccc2C)C#N
InChI=1SC24H23ClN4O4c11564102921(15)2823(33187820(25)16(2)1218)19(24(29)31)1317(1426)22(30)279511323h468101213H5911H213H3(H2730)b1713+
MFCD04166051
ZINC000002412883
ZINC2412883
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