Vitas-M small molecule compound
(2E)-N-(3-acetylphenyl)-3-[3-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyanoprop-2-enamide
Catalog ID
STK473860
SMILES N#C/C(=C\c1c[nH]nc1c1ccc(cc1)Br)/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 C21H15BrN4O2 MW 435.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN4O2/c1-13(27)15-3-2-4-19(10-15)25-21(28)16(11-23)9-17-12-24-26-20(17)14-5-7-18(22)8-6-14/h2-10,12H,1H3,(H,24,26)(H,25,28)/b16-9+InChIKey
FGPPIVNCVXEWRD-CXUHLZMHSA-NSynonyms
(2E)N(3acetylphenyl)3(3(4bromophenyl)1Hpyrazol4yl)2cyanoprop2enamide
(E)N(3acetylphenyl)3(5(4bromophenyl)1Hpyrazol4yl)2cyanoprop2enamide
CC(=O)C1=CC(=CC=C1)NC(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Br)C#N
InChI=1SC21H15BrN4O2c113(27)1532419(1015)2521(28)16(1123)91712242620(17)145718(22)8614h21012H1H3(H2426)(H2528)b169+
MFCD06160740
N#CC(=Cc1c(nH)nc1c1ccc(cc1)Br)C(=O)Nc1cccc(c1)C(=O)C
ZINC000017099375
ZINC17099375
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