Vitas-M small molecule compound

(2Z)-2-(morpholin-4-ylcarbonyl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile

Catalog ID
STK881049
SMILES CCCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)N1CCOCC1)/C#N)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 C26H26N4O2S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O2S/c1-2-16-33-24-10-8-20(9-11-24)25-22(19-30(28-25)23-6-4-3-5-7-23)17-21(18-27)26(31)29-12-14-32-15-13-29/h3-11,17,19H,2,12-16H2,1H3/b21-17-
InChIKey
GGETULYJKSLRDT-FXBPSFAMSA-N
Synonyms
1164497-15-7
(2Z)2(morpholin4ylcarbonyl)3(1phenyl3(4(propylsulfanyl)phenyl)1Hpyrazol4yl)prop2enenitrile
(Z)2(4MORPHOLINYL(OXO)METHYL)3(1PHENYL3(4(PROPYLTHIO)PHENYL)4PYRAZOLYL)2PROPENENITRILE
(Z)2(morpholine4carbonyl)3(1phenyl3(4(propylthio)phenyl)1Hpyrazol4yl)acrylonitrile
(Z)2(MORPHOLINE4CARBONYL)3(1PHENYL3(4(PROPYLTHIO)PHENYL)PYRAZOL4YL)ACRYLONITRILE
(Z)2(MORPHOLINE4CARBONYL)3(1PHENYL3(4PROPYLSULFANYLPHENYL)1HPYRAZOL4YL)ACRYLONITRILE
(Z)2(MORPHOLINE4CARBONYL)3(1PHENYL3(4PROPYLSULFANYLPHENYL)PYRAZOL4YL)PROP2ENENITRILE
(Z)2MORPHOLIN4YLCARBONYL3(1PHENYL3(4PROPYLSULFANYLPHENYL)PYRAZOL4YL)PROP2ENENITRILE
1164497157
CCCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)N3CCOCC3)C4=CC=CC=C4
CCCSc1ccc(cc1)c1nn(cc1C=C(C(=O)N1CCOCC1)C#N)c1ccccc1
InChI=1SC26H26N4O2Sc1216332410820(91124)2522(1930(2825)236435723)1721(1827)26(31)29121432151329h3111719H21216H21H3b2117
MFCD03684748
ZINC000002246394
ZINC02246394
ZINC2246394

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Available files

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