Vitas-M small molecule compound
(2Z)-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK460575
SMILES N#C/C(=C/c1ccc(c(c1)CN1CCSCC1)OC)/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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-26-21-8-7-17(13-18(21)16-23-9-11-27-12-10-23)14-20(15-22)28(24,25)19-5-3-2-4-6-19/h2-8,13-14H,9-12,16H2,1H3/b20-14-InChIKey
UOFOTSZMKVTLOE-ZHZULCJRSA-NSynonyms
(2Z)3(4METHOXY3(14THIAZAPERHYDROIN4YLMETHYL)PHENYL)2(PHENYLSULFONYL)PROP2ENENITRILE
(2Z)3(4methoxy3(thiomorpholin4ylmethyl)phenyl)2(phenylsulfonyl)prop2enenitrile
(Z)2(BENZENESULFONYL)3(4METHOXY3(THIOMORPHOLIN4YLMETHYL)PHENYL)PROP2ENENITRILE
COC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)CN3CCSCC3
InChI=1SC21H22N2O3S2c126218717(1318(21)162391127121023)1420(1522)28(2425)195324619h281314H91216H21H3b2014
MFCD05991612
N#CC(=Cc1ccc(c(c1)CN1CCSCC1)OC)S(=O)(=O)c1ccccc1
ZINC000032575717
ZINC32575717
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