Vitas-M small molecule compound

(2E)-3-{3-[4-(morpholin-4-ylsulfonyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-(phenylsulfonyl)prop-2-enenitrile

Catalog ID
STK822958
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCOCC1)c1ccccc1)/S(=O)(=O)c1ccccc1

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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 C28H24N4O5S2 MW 560.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O5S2/c29-20-27(38(33,34)25-9-5-2-6-10-25)19-23-21-32(24-7-3-1-4-8-24)30-28(23)22-11-13-26(14-12-22)39(35,36)31-15-17-37-18-16-31/h1-14,19,21H,15-18H2/b27-19+
InChIKey
UTXXJQFEMQZOJB-ZXVVBBHZSA-N
Synonyms

(2E)2(BENZENESULFONYL)3(3(4(MORPHOLINE4SULFONYL)PHENYL)1PHENYL1HPYRAZOL4YL)PROP2ENENITRILE
(2E)3(3(4(morpholin4ylsulfonyl)phenyl)1phenyl1Hpyrazol4yl)2(phenylsulfonyl)prop2enenitrile
(E)2(benzenesulfonyl)3(3(4morpholin4ylsulfonylphenyl)1phenylpyrazol4yl)prop2enenitrile
C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=NN(C=C3C=C(C#N)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC28H24N4O5S2c292027(38(3334)2595261025)19232132(247314824)3028(23)22111326(141222)39(3536)31151737181631h1141921H1518H2b2719+
MFCD03463517
N#CC(=Cc1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCOCC1)c1ccccc1)S(=O)(=O)c1ccccc1
ZINC000101335063
ZINC101335063

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Available files

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