Vitas-M small molecule compound
(4E)-2-(4-bromophenyl)-4-{[(4-methoxyphenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295831
SMILES COc1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Br)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 C18H16BrN3O2 MW 386.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3O2/c1-12-17(11-20-14-5-9-16(24-2)10-6-14)18(23)22(21-12)15-7-3-13(19)4-8-15/h3-11,20H,1-2H3/b17-11+InChIKey
WGEPVOHYMOAYLC-GZTJUZNOSA-NSynonyms
(4E)2(4bromophenyl)4(((4methoxyphenyl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(4bromophenyl)4((4methoxyanilino)methylidene)5methylpyrazol3one
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)OC)C3=CC=C(C=C3)Br
COc1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(cc1)Br)C
InChI=1SC18H16BrN3O2c11217(1120145916(242)10614)18(23)22(2112)157313(19)4815h31120H12H3b1711+
MFCD28033173
ZINC000101129608
ZINC101129608
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