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2-(4-chlorophenyl)-4-({[4'-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)biphenyl-4-yl]amino}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK670946
SMILES Clc1ccc(cc1)N1N=C(/C(=C\Nc2ccc(cc2)c2ccc(cc2)N/C=C/2\C(=NN(C2=O)c2ccc(cc2)Cl)C)/C1=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 C34H26Cl2N6O2 MW 621.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26Cl2N6O2/c1-21-31(33(43)41(39-21)29-15-7-25(35)8-16-29)19-37-27-11-3-23(4-12-27)24-5-13-28(14-6-24)38-20-32-22(2)40-42(34(32)44)30-17-9-26(36)10-18-30/h3-20,37-38H,1-2H3/b31-19+,32-20+
InChIKey
DUJNKKCBSYNHCW-GKTLAHRSSA-N
Synonyms

(4E)2(4chlorophenyl)4((4(4(((E)(1(4chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)phenyl)anilino)methylidene)5methylpyrazol3one
2(4chlorophenyl)4(((4(((E)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)biphenyl4yl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)C3=CC=C(C=C3)NC=C4C(=NN(C4=O)C5=CC=C(C=C5)Cl)C)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)N1N=C(C(=CNc2ccc(cc2)c2ccc(cc2)NC=C2C(=NN(C2=O)c2ccc(cc2)Cl)C)C1=O)C
InChI=1SC34H26Cl2N6O2c12131(33(43)41(3921)2915725(35)81629)19372711323(41227)2451328(14624)38203222(2)4042(34(32)44)3017926(36)101830h3203738H12H3b3119+3220+
MFCD00740446
ZINC000100040852
ZINC000100040854
ZINC100040854

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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