Vitas-M small molecule compound
(4E)-4-[(1-{3-[(4-fluorobenzyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK576010
SMILES OC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)CNCc1ccc(cc1)F
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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 C29H27FN4O2 MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27FN4O2/c1-20-27(29(36)34(32-20)24-7-3-2-4-8-24)15-22-18-33(28-10-6-5-9-26(22)28)19-25(35)17-31-16-21-11-13-23(30)14-12-21/h2-15,18,25,31,35H,16-17,19H2,1H3/b27-15+InChIKey
WATPQMAWQGUGBL-JFLMPSFJSA-NSynonyms
892627-10-0(4E)4((1(3((4fluorobenzyl)amino)2hydroxypropyl)1Hindol3yl)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((1(3((4fluorophenyl)methylamino)2hydroxypropyl)indol3yl)methylidene)5methyl2phenylpyrazol3one
(E)4((1(3((4fluorobenzyl)amino)2hydroxypropyl)1Hindol3yl)methylene)3methyl1phenyl1Hpyrazol5(4H)one
892627100
CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNCC4=CC=C(C=C4)F)O)C5=CC=CC=C5
InChI=1SC29H27FN4O2c12027(29(36)34(3220)247324824)15221833(281065926(22)28)1925(35)17311621111323(30)141221h21518253135H161719H21H3b2715+
MFCD06787604
OC(Cn1cc(c2c1cccc2)C=C1C(=NN(C1=O)c1ccccc1)C)CNCc1ccc(cc1)F
ZINC000101354365
ZINC000101354366
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