Vitas-M small molecule compound

(2Z)-2-cyano-N-(furan-2-ylmethyl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enamide

Catalog ID
STK881077
SMILES CCCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NCc1ccco1)/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 C27H24N4O2S MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O2S/c1-2-15-34-25-12-10-20(11-13-25)26-22(19-31(30-26)23-7-4-3-5-8-23)16-21(17-28)27(32)29-18-24-9-6-14-33-24/h3-14,16,19H,2,15,18H2,1H3,(H,29,32)/b21-16-
InChIKey
OCENZWOFDHQZMM-PGMHBOJBSA-N
Synonyms
1009434-16-5
(2Z)2cyanoN(furan2ylmethyl)3(1phenyl3(4(propylsulfanyl)phenyl)1Hpyrazol4yl)prop2enamide
(Z)2cyanoN(furan2ylmethyl)3(1phenyl3(4(propylthio)phenyl)1Hpyrazol4yl)acrylamide
(Z)2CYANON(FURAN2YLMETHYL)3(1PHENYL3(4PROPYLSULFANYLPHENYL)PYRAZOL4YL)PROP2ENAMIDE
1009434165
CCCSC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CO3)C4=CC=CC=C4
InChI=1SC27H24N4O2Sc12153425121020(111325)2622(1931(3026)237435823)1621(1728)27(32)29182496143324h3141619H21518H21H3(H2932)b2116
MFCD03688844
ZINC000009461784
ZINC09461784
ZINC9461784

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Available files

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