Vitas-M small molecule compound

(4E)-4-[(1-{3-[(4-acetylphenyl)amino]-2-hydroxypropyl}-1H-indol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK600361
SMILES OC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)CNc1ccc(cc1)C(=O)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 C30H28N4O3 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O3/c1-20-28(30(37)34(32-20)25-8-4-3-5-9-25)16-23-18-33(29-11-7-6-10-27(23)29)19-26(36)17-31-24-14-12-22(13-15-24)21(2)35/h3-16,18,26,31,36H,17,19H2,1-2H3/b28-16+
InChIKey
JPYRAGKNBVHMIW-LQKURTRISA-N
Synonyms
892627-76-8
(4E)4((1(3((4acetylphenyl)amino)2hydroxypropyl)1Hindol3yl)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((1(3(4ACETYLANILINO)2HYDROXYPROPYL)INDOL3YL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(E)4((1(3((4acetylphenyl)amino)2hydroxypropyl)1Hindol3yl)methylene)3methyl1phenyl1Hpyrazol5(4H)one
892627768
CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNC4=CC=C(C=C4)C(=O)C)O)C5=CC=CC=C5
InChI=1SC30H28N4O3c12028(30(37)34(3220)258435925)16231833(2911761027(23)29)1926(36)173124141222(131524)21(2)35h31618263136H1719H212H3b2816+
MFCD06790241
OC(Cn1cc(c2c1cccc2)C=C1C(=NN(C1=O)c1ccccc1)C)CNc1ccc(cc1)C(=O)C
ZINC000101358896
ZINC000101358900

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Available files

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