Vitas-M small molecule compound

(2Z)-2-cyano-3-{3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-methylprop-2-enamide

Catalog ID
STK706815
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NC)/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 C22H20N4OS MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4OS/c1-3-28-20-11-9-16(10-12-20)21-18(13-17(14-23)22(27)24-2)15-26(25-21)19-7-5-4-6-8-19/h4-13,15H,3H2,1-2H3,(H,24,27)/b17-13-
InChIKey
YXHFUHKQZRKBOM-LGMDPLHJSA-N
Synonyms
958946-25-3
(2Z)2cyano3(3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)Nmethylprop2enamide
(Z)2cyano3(3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)Nmethylacrylamide
(Z)2CYANO3(3(4(ETHYLTHIO)PHENYL)1PHENYL4PYRAZOLYL)NMETHYL2PROPENAMIDE
(Z)2CYANO3(3(4(ETHYLTHIO)PHENYL)1PHENYLPYRAZOL4YL)NMETHYLACRYLAMIDE
(Z)2CYANO3(3(4ETHYLSULFANYLPHENYL)1PHENYL1HPYRAZOL4YL)NMETHYLACRYLAMIDE
(Z)2CYANO3(3(4ETHYLSULFANYLPHENYL)1PHENYLPYRAZOL4YL)NMETHYLPROP2ENAMIDE
958946253
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC)C3=CC=CC=C3
CCSc1ccc(cc1)c1nn(cc1C=C(C(=O)NC)C#N)c1ccccc1
InChI=1SC22H20N4OSc13282011916(101220)2118(1317(1423)22(27)242)1526(2521)197546819h41315H3H212H3(H2427)b1713
MFCD03687620
ZINC000013496592
ZINC13496592

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.