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-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)prop-2-enamide
Catalog ID
STK515122
SMILES N#C/C(=C\c1c(Oc2ccc(c(c2)C)Cl)nc2n(c1=O)cccc2C)/C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
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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 C31H25ClN6O4 MW 581.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN6O4/c1-18-9-8-14-37-27(18)35-29(42-23-12-13-25(32)19(2)15-23)24(30(37)40)16-21(17-33)28(39)34-26-20(3)36(4)38(31(26)41)22-10-6-5-7-11-22/h5-16H,1-4H3,(H,34,39)/b21-16+InChIKey
AKPGMVCBGRJSKP-LTGZKZEYSA-NSynonyms
620536-94-9(2E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)prop2enamide
(E)3(2(4chloro3methylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)acrylamide
(E)3(2(4CHLORO3METHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANON(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)PROP2ENAMIDE
620536949
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OC5=CC(=C(C=C5)Cl)C
InChI=1SC31H25ClN6O4c11898143727(18)3529(4223121325(32)19(2)1523)24(30(37)40)1621(1733)28(39)342620(3)36(4)38(31(26)41)22106571122h516H14H3(H3439)b2116+
MFCD05692779
N#CC(=Cc1c(Oc2ccc(c(c2)C)Cl)nc2n(c1=O)cccc2C)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
ZINC000002395480
ZINC2395480
Check stock
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Check stock on Vitas-MAvailable files
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