Vitas-M small molecule compound

(4Z)-5-methyl-4-({3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK811551
SMILES C=CCOc1ccc(c(c1)C)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)C)c1ccccc1

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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 C30H26N4O2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O2/c1-4-17-36-26-15-16-27(21(2)18-26)29-23(20-33(32-29)24-11-7-5-8-12-24)19-28-22(3)31-34(30(28)35)25-13-9-6-10-14-25/h4-16,18-20H,1,17H2,2-3H3/b28-19-
InChIKey
JYERWZVCRVXJHU-USHMODERSA-N
Synonyms

(4Z)5methyl4((3(2methyl4(prop2en1yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2phenyl24dihydro3Hpyrazol3one
(4Z)5METHYL4((3(2METHYL4PROP2ENOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PHENYLPYRAZOL3ONE
C=CCOc1ccc(c(c1)C)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)C)c1ccccc1
CC1=C(C=CC(=C1)OCC=C)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C)C5=CC=CC=C5
InChI=1SC30H26N4O2c14173626151627(21(2)1826)2923(2033(3229)24117581224)192822(3)3134(30(28)35)251396101425h4161820H117H223H3b2819
MFCD06264895
ZINC000016713675
ZINC16713675

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Available files

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