Vitas-M small molecule compound
(2E)-1-(1-hydroxynaphthalen-2-yl)-3-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}prop-2-en-1-one
Catalog ID
STK496948
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])/C=C/C(=O)c1ccc2c(c1O)cccc2
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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 C24H19N3O5 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O5/c1-32-23-11-7-16(12-18(23)14-26-15-19(13-25-26)27(30)31)6-10-22(28)21-9-8-17-4-2-3-5-20(17)24(21)29/h2-13,15,29H,14H2,1H3/b10-6+InChIKey
BLGDIMAHJZCUQW-UXBLZVDNSA-NSynonyms
(2E)1(1hydroxynaphthalen2yl)3(4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)prop2en1one
(E)1(1hydroxynaphthalen2yl)3(4methoxy3((4nitropyrazol1yl)methyl)phenyl)prop2en1one
COC1=C(C=C(C=C1)C=CC(=O)C2=C(C3=CC=CC=C3C=C2)O)CN4C=C(C=N4)(N+)(=O)(O)
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C=CC(=O)c1ccc2c(c1O)cccc2
InChI=1SC24H19N3O5c1322311716(1218(23)14261519(132526)27(30)31)61022(28)219817423520(17)24(21)29h2131529H14H21H3b106+
MFCD08134980
ZINC000020258708
ZINC20258708
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