Vitas-M small molecule compound
(2E)-N-(1-benzyl-1H-pyrazol-4-yl)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}prop-2-enamide
Catalog ID
STK961044
SMILES COc1ccc(cc1COc1ccc(cc1)Br)/C=C/C(=O)Nc1cnn(c1)Cc1ccccc1
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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 C27H24BrN3O3 MW 518.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24BrN3O3/c1-33-26-13-7-20(15-22(26)19-34-25-11-9-23(28)10-12-25)8-14-27(32)30-24-16-29-31(18-24)17-21-5-3-2-4-6-21/h2-16,18H,17,19H2,1H3,(H,30,32)/b14-8+InChIKey
RMRZLZBPOGSOEG-RIYZIHGNSA-NSynonyms
515857-36-0(2E)N(1benzyl1Hpyrazol4yl)3(3((4bromophenoxy)methyl)4methoxyphenyl)prop2enamide
(E)N(1BENZYLPYRAZOL4YL)3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)PROP2ENAMIDE
515857360
COC1=C(C=C(C=C1)C=CC(=O)NC2=CN(N=C2)CC3=CC=CC=C3)COC4=CC=C(C=C4)Br
COc1ccc(cc1COc1ccc(cc1)Br)C=CC(=O)Nc1cnn(c1)Cc1ccccc1
InChI=1SC27H24BrN3O3c1332613720(1522(26)19342511923(28)101225)81427(32)3024162931(1824)17215324621h21618H1719H21H3(H3032)b148+
MFCD02243785
N(1BENZYL1HPYRAZOL4YL)3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)ACRYLAMIDE
ZINC000002769688
ZINC02769688
ZINC2769688
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