Vitas-M small molecule compound
(2E)-2-cyano-3-{1-phenyl-3-[3-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK904374
SMILES N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1)/C(=O)NCC1CCCO1
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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 C29H31N5O4S MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O4S/c30-19-23(29(35)31-20-26-12-8-16-38-26)17-24-21-34(25-10-3-1-4-11-25)32-28(24)22-9-7-13-27(18-22)39(36,37)33-14-5-2-6-15-33/h1,3-4,7,9-11,13,17-18,21,26H,2,5-6,8,12,14-16,20H2,(H,31,35)/b23-17+InChIKey
PAYISELTNFRUBZ-HAVVHWLPSA-NSynonyms
(2E)2cyano3(1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)N(tetrahydrofuran2ylmethyl)prop2enamide
(E)2cyanoN(oxolan2ylmethyl)3(1phenyl3(3piperidin1ylsulfonylphenyl)pyrazol4yl)prop2enamide
(Z)2cyano3(1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)N((tetrahydrofuran2yl)methyl)acrylamide
C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C(C#N)C(=O)NCC4CCCO4)C5=CC=CC=C5
InChI=1SC29H31N5O4Sc301923(29(35)312026128163826)17242134(25103141125)3228(24)22971327(1822)39(3637)33145261533h13479111317182126H256812141620H2(H3135)b2317+
MFCD18076060
N#CC(=Cc1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1)C(=O)NCC1CCCO1
ZINC000097947312
ZINC000097947313
Check stock
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