Vitas-M small molecule compound
(2Z)-3-{3-[4-(butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-cyano-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide
Catalog ID
STK881565
SMILES CCCCSc1ccc(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 C29H30N6OS MW 510.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N6OS/c1-2-3-18-37-27-12-10-23(11-13-27)28-25(21-35(33-28)26-8-5-4-6-9-26)19-24(20-30)29(36)32-14-7-16-34-17-15-31-22-34/h4-6,8-13,15,17,19,21-22H,2-3,7,14,16,18H2,1H3,(H,32,36)/b24-19-InChIKey
MAAVIBOHYOJHJH-CLCOLTQESA-NSynonyms
1009186-47-3(2Z)3(3(4(butylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(3(1Himidazol1yl)propyl)prop2enamide
(Z)3(3(4butylsulfanylphenyl)1phenylpyrazol4yl)2cyanoN(3imidazol1ylpropyl)prop2enamide
(Z)N(3(1Himidazol1yl)propyl)3(3(4(butylthio)phenyl)1phenyl1Hpyrazol4yl)2cyanoacrylamide
1009186473
CCCCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4
CCCCSc1ccc(cc1)c1nn(cc1C=C(C(=O)NCCCn1cncc1)C#N)c1ccccc1
InChI=1SC29H30N6OSc123183727121023(111327)2825(2135(3328)268546926)1924(2030)29(36)3214716341715312234h468131517192122H237141618H21H3(H3236)b2419
MFCD03693410
ZINC000009507932
ZINC09507932
ZINC9507932
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