Vitas-M small molecule compound

4,4'-[(4-chlorophenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)

Catalog ID
STL362891
SMILES Clc1ccc(cc1)C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)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 C29H27ClN4O2 MW 499.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN4O2/c1-19-25(28(35)33(31(19)3)23-11-7-5-8-12-23)27(21-15-17-22(30)18-16-21)26-20(2)32(4)34(29(26)36)24-13-9-6-10-14-24/h5-18,27H,1-4H3
InChIKey
AHLSOESUETYWBK-UHFFFAOYSA-N
Synonyms
1606-54-8
1606548
4((4CHLOROPHENYL)(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)METHYL)15DIMETHYL2PHENYLPYRAZOL3ONE
44((4chlorophenyl)methanediyl)bis(15dimethyl2phenyl12dihydro3Hpyrazol3one)
44((4chlorophenyl)methylene)bis(15dimethyl2phenyl1Hpyrazol3(2H)one)
44(4CHLOROBENZYLIDENE)BIS(15DIMETHYL2PHENYL1HPYRAZOLE3(2H)ONE)
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=C(C=C3)Cl)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC29H27ClN4O2c11925(28(35)33(31(19)3)23117581223)27(21151722(30)181621)2620(2)32(4)34(29(26)36)241396101424h51827H14H3
MFCD00477727
ZINC000004010328
ZINC04010328
ZINC4010328

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Available files

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