Vitas-M small molecule compound
2-oxo-2-phenylethyl 3-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name)
Catalog ID
STK268443
SMILES O=C1N(c2cccc(c2)C(=O)OCC(=O)c2ccccc2)C(=O)C2C1C1(Br)c3c(C2(Br)c2c1cccc2)cccc3
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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 C33H21Br2NO5 MW 671.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H21Br2NO5/c34-32-22-13-4-5-14-23(22)33(35,25-16-7-6-15-24(25)32)28-27(32)29(38)36(30(28)39)21-12-8-11-20(17-21)31(40)41-18-26(37)19-9-2-1-3-10-19/h1-17,27-28H,18H2InChIKey
ZTPYPHNBYCTYCH-UHFFFAOYSA-NSynonyms
2oxo2phenylethyl3(18dibromo1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)C4C(C3=O)C5(C6=CC=CC=C6C4(C7=CC=CC=C75)Br)Br
InChI=1SC33H21Br2NO5c34322213451423(22)33(352516761524(25)32)2827(32)29(38)36(30(28)39)211281120(1721)31(40)411826(37)1992131019h1172728H18H2
MFCD01156463
ZINC000008449483
ZINC000008449494
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