Vitas-M small molecule compound
ethyl 4-({(2Z)-2-cyano-3-[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enoyl}amino)benzoate
Catalog ID
STK820379
SMILES CCOC(=O)c1ccc(cc1)NC(=O)/C(=C\c1cn(nc1c1ccc(cc1)C)c1ccccc1)/C#N
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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/c1-3-36-29(35)22-13-15-25(16-14-22)31-28(34)23(18-30)17-24-19-33(26-7-5-4-6-8-26)32-27(24)21-11-9-20(2)10-12-21/h4-17,19H,3H2,1-2H3,(H,31,34)/b23-17-InChIKey
MQQLYYMMTZIFIE-QJOMJCCJSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)C)C4=CC=CC=C4)C#N
CCOC(=O)c1ccc(cc1)NC(=O)C(=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1)C#N
ethyl4(((2Z)2cyano3(3(4methylphenyl)1phenyl1Hpyrazol4yl)prop2enoyl)amino)benzoate
ethyl4(((Z)2cyano3(3(4methylphenyl)1phenylpyrazol4yl)prop2enoyl)amino)benzoate
InChI=1SC29H24N4O3c133629(35)22131525(161422)3128(34)23(1830)17241933(267546826)3227(24)2111920(2)101221h41719H3H212H3(H3134)b2317
MFCD06644910
ZINC000016741425
ZINC16741425
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