Vitas-M small molecule compound
1-bromo-17-[4-chloro-2-(phenylcarbonyl)phenyl]-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STK268677
SMILES Clc1ccc(c(c1)C(=O)c1ccccc1)N1C(=O)C2C(C1=O)C1(Br)c3c(C2c2c1cccc2)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 C31H19BrClNO3 MW 568.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H19BrClNO3/c32-31-22-12-6-4-10-19(22)25(20-11-5-7-13-23(20)31)26-27(31)30(37)34(29(26)36)24-15-14-18(33)16-21(24)28(35)17-8-2-1-3-9-17/h1-16,25-27HInChIKey
LVOREZQZQMCWHW-UHFFFAOYSA-NSynonyms
1bromo17(4chloro2(phenylcarbonyl)phenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)N3C(=O)C4C5C6=CC=CC=C6C(C4C3=O)(C7=CC=CC=C57)Br
InChI=1SC31H19BrClNO3c32312212641019(22)25(2011571323(20)31)2627(31)30(37)34(29(26)36)24151418(33)1621(24)28(35)178213917h1162527H
MFCD01174885
ZINC000002068302
ZINC000002068305
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