Vitas-M small molecule compound

(2E)-N-(3-acetylphenyl)-3-[1-benzyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2-cyanoprop-2-enamide

Catalog ID
STK474003
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OC)Cc1ccccc1)/C(=O)Nc1cccc(c1)C(=O)C

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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 C29H24N4O3 MW 476.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O3/c1-20(34)23-9-6-10-26(16-23)31-29(35)24(17-30)15-25-19-33(18-21-7-4-3-5-8-21)32-28(25)22-11-13-27(36-2)14-12-22/h3-16,19H,18H2,1-2H3,(H,31,35)/b24-15+
InChIKey
CHGUTIAVEQZMNY-BUVRLJJBSA-N
Synonyms

(2E)N(3ACETYLPHENYL)2CYANO3(3(4METHOXYPHENYL)1BENZYLPYRAZOL4YL)PROP2ENAMIDE
(2E)N(3acetylphenyl)3(1benzyl3(4methoxyphenyl)1Hpyrazol4yl)2cyanoprop2enamide
(E)N(3acetylphenyl)3(1benzyl3(4methoxyphenyl)pyrazol4yl)2cyanoprop2enamide
CC(=O)C1=CC(=CC=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OC)CC4=CC=CC=C4)C#N
InChI=1SC29H24N4O3c120(34)23961026(1623)3129(35)24(1730)15251933(18217435821)3228(25)22111327(362)141222h31619H18H212H3(H3135)b2415+
MFCD06186059
N#CC(=Cc1cn(nc1c1ccc(cc1)OC)Cc1ccccc1)C(=O)Nc1cccc(c1)C(=O)C
ZINC000020310963
ZINC20310963

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Available files

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