Vitas-M small molecule compound
(2Z)-N-(2-chlorophenyl)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK800860
SMILES CCOc1ccc(cc1C)c1nn(cc1/C=C(\C(=O)Nc1ccccc1Cl)/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 C28H23ClN4O2 MW 482.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O2/c1-3-35-26-14-13-20(15-19(26)2)27-22(18-33(32-27)23-9-5-4-6-10-23)16-21(17-30)28(34)31-25-12-8-7-11-24(25)29/h4-16,18H,3H2,1-2H3,(H,31,34)/b21-16-InChIKey
SUZBXQYVCKAWKU-PGMHBOJBSA-NSynonyms
(2Z)N(2chlorophenyl)2cyano3(3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)N(2chlorophenyl)2cyano3(3(4ethoxy3methylphenyl)1phenylpyrazol4yl)prop2enamide
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3=CC=CC=C3Cl)C4=CC=CC=C4)C
CCOc1ccc(cc1C)c1nn(cc1C=C(C(=O)Nc1ccccc1Cl)C#N)c1ccccc1
InChI=1SC28H23ClN4O2c133526141320(1519(26)2)2722(1833(3227)2395461023)1621(1730)28(34)312512871124(25)29h41618H3H212H3(H3134)b2116
MFCD06642948
ZINC000016736019
ZINC16736019
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