Vitas-M small molecule compound
1-methyl-17-[3-(trifluoromethyl)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
STK862577
SMILES O=C1N(c2cccc(c2)C(F)(F)F)C(=O)C2C1C1c3ccccc3C2(c2c1cccc2)C
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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 C26H18F3NO2 MW 433.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18F3NO2/c1-25-18-11-4-2-9-16(18)20(17-10-3-5-12-19(17)25)21-22(25)24(32)30(23(21)31)15-8-6-7-14(13-15)26(27,28)29/h2-13,20-22H,1H3InChIKey
KRQIILQWVUYYST-UHFFFAOYSA-NSynonyms
(9R10R11S15S)9methyl13(3(trifluoromethyl)phenyl)1115dihydro9H910(34)epipyrroloanthracene1214(10H13H)dione
1methyl17(3(trifluoromethyl)phenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CC=CC(=C6)C(F)(F)F
InChI=1SC26H18F3NO2c125181142916(18)20(1710351219(17)25)2122(25)24(32)30(23(21)31)1586714(1315)26(2728)29h2132022H1H3
MFCD00755453
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@@H)2C1C1c3ccccc3C2(c2c1cccc2)C
ZINC000000842026
ZINC000000842029
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