Vitas-M small molecule compound

[5-(2-chloro-7-methoxyquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl](phenyl)methanone

Catalog ID
STK841806
SMILES COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)c1ccccc1)c1ccc(cc1)C)Cl

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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 C27H22ClN3O2 MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O2/c1-17-8-10-18(11-9-17)24-16-25(31(30-24)27(32)19-6-4-3-5-7-19)22-14-20-12-13-21(33-2)15-23(20)29-26(22)28/h3-15,25H,16H2,1-2H3
InChIKey
AJXAHUOZEIEQRZ-UHFFFAOYSA-N
Synonyms
383892-19-1
(3(2CHLORO7METHOXYQUINOLIN3YL)5(4METHYLPHENYL)34DIHYDROPYRAZOL2YL)PHENYLMETHANONE
(5(2chloro7methoxyquinolin3yl)3(4methylphenyl)45dihydro1Hpyrazol1yl)(phenyl)methanone
(5(2CHLORO7METHOXYQUINOLIN3YL)3(PTOLYL)45DIHYDRO1HPYRAZOL1YL)(PHENYL)METHANONE
383892191
CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C(C=CC4=C3)OC)Cl)C(=O)C5=CC=CC=C5
InChI=1SC27H22ClN3O2c11781018(11917)241625(31(3024)27(32)196435719)221420121321(332)1523(20)2926(22)28h31525H16H212H3
MFCD03000495
ZINC000009334513
ZINC000009444491

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Available files

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