Vitas-M small molecule compound
N-{(1Z)-1-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxo-3-[(tetrahydrofuran-2-ylmethyl)amino]prop-1-en-2-yl}benzamide
Catalog ID
STK983105
SMILES COc1ccc(cc1Br)c1nn(cc1/C=C(/C(=O)NCC1CCCO1)\NC(=O)c1ccccc1)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 C31H29BrN4O4 MW 601.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrN4O4/c1-39-28-15-14-22(17-26(28)32)29-23(20-36(35-29)24-11-6-3-7-12-24)18-27(31(38)33-19-25-13-8-16-40-25)34-30(37)21-9-4-2-5-10-21/h2-7,9-12,14-15,17-18,20,25H,8,13,16,19H2,1H3,(H,33,38)(H,34,37)/b27-18-InChIKey
NHWBTYOKKQAMEF-IMRQLAEWSA-NSynonyms
(2Z)3(3(3BROMO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)N(OXOLAN2YLMETHYL)2(PHENYLCARBONYLAMINO)PROP2ENAMIDE
(Z)N(1(3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)3oxo3(((tetrahydrofuran2yl)methyl)amino)prop1en2yl)benzamide
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C(=O)NCC3CCCO3)NC(=O)C4=CC=CC=C4)C5=CC=CC=C5)Br
InChI=1SC31H29BrN4O4c13928151422(1726(28)32)2923(2036(3529)24116371224)1827(31(38)331925138164025)3430(37)2194251021h27912141517182025H8131619H21H3(H3338)(H3437)b2718
MFCD03298203
N((1Z)1(3(3bromo4methoxyphenyl)1phenyl1Hpyrazol4yl)3oxo3((tetrahydrofuran2ylmethyl)amino)prop1en2yl)benzamide
N((Z)1(3(3bromo4methoxyphenyl)1phenylpyrazol4yl)3oxo3(oxolan2ylmethylamino)prop1en2yl)benzamide
ZINC000097947563
ZINC000097947564
Check stock
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Check stock on Vitas-MAvailable files
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