Vitas-M small molecule compound
(2E)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[2-(4-ethylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Catalog ID
STK705898
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)CC)nc2n(c1=O)cccc2)/C(=O)NC1CCS(=O)(=O)C1
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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 C24H22N4O5S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5S/c1-2-16-6-8-19(9-7-16)33-23-20(24(30)28-11-4-3-5-21(28)27-23)13-17(14-25)22(29)26-18-10-12-34(31,32)15-18/h3-9,11,13,18H,2,10,12,15H2,1H3,(H,26,29)/b17-13+InChIKey
VTOFPLLNHBMFKH-GHRIWEEISA-NSynonyms
620106-87-8(2E)2cyanoN(11dioxidotetrahydrothiophen3yl)3(2(4ethylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyanoN(11dioxidotetrahydrothiophen3yl)3(2(4ethylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)acrylamide
(E)2CYANON(11DIOXOTHIOLAN3YL)3(2(4ETHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
620106878
CCC1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NC4CCS(=O)(=O)C4
InChI=1SC24H22N4O5Sc12166819(9716)332320(24(30)281143521(28)2723)1317(1425)22(29)2618101234(3132)1518h39111318H2101215H21H3(H2629)b1713+
MFCD04164775
N#CC(=Cc1c(Oc2ccc(cc2)CC)nc2n(c1=O)cccc2)C(=O)NC1CCS(=O)(=O)C1
ZINC000009003820
ZINC000009003821
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.