Vitas-M small molecule compound
(2Z)-2-cyano-3-{3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide
Catalog ID
STL236791
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NCCCn1cncc1)/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 C27H26N6OS MW 482.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N6OS/c1-2-35-25-11-9-21(10-12-25)26-23(19-33(31-26)24-7-4-3-5-8-24)17-22(18-28)27(34)30-13-6-15-32-16-14-29-20-32/h3-5,7-12,14,16-17,19-20H,2,6,13,15H2,1H3,(H,30,34)/b22-17-InChIKey
CVYIZJPUKVAMTH-XLNRJJMWSA-NSynonyms
1008879-28-4(2Z)2cyano3(3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)N(3(1Himidazol1yl)propyl)prop2enamide
(Z)2cyano3(3(4ethylsulfanylphenyl)1phenylpyrazol4yl)N(3imidazol1ylpropyl)prop2enamide
(Z)N(3(1Himidazol1yl)propyl)2cyano3(3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)acrylamide
1008879284
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4
CCSc1ccc(cc1)c1nn(cc1C=C(C(=O)NCCCn1cncc1)C#N)c1ccccc1
InChI=1SC27H26N6OSc12352511921(101225)2623(1933(3126)247435824)1722(1828)27(34)3013615321614292032h357121416171920H261315H21H3(H3034)b2217
MFCD03690504
ZINC000009462530
ZINC09462530
ZINC9462530
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