Vitas-M small molecule compound

[5-(2-chloro-6-ethoxyquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl](thiophen-2-yl)methanone

Catalog ID
STL000012
SMILES CCOc1ccc2c(c1)cc(c(n2)Cl)C1CC(=NN1C(=O)c1cccs1)c1ccc(cc1)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 C26H22ClN3O2S MW 476.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O2S/c1-3-32-19-10-11-21-18(13-19)14-20(25(27)28-21)23-15-22(17-8-6-16(2)7-9-17)29-30(23)26(31)24-5-4-12-33-24/h4-14,23H,3,15H2,1-2H3
InChIKey
PVDKLDNAWCRFES-UHFFFAOYSA-N
Synonyms
685135-44-8
(3(2CHLORO6ETHOXYQUINOLIN3YL)5(4METHYLPHENYL)34DIHYDROPYRAZOL2YL)THIOPHEN2YLMETHANONE
(5(2chloro6ethoxyquinolin3yl)3(4methylphenyl)45dihydro1Hpyrazol1yl)(thiophen2yl)methanone
(5(2CHLORO6ETHOXYQUINOLIN3YL)3(PTOLYL)45DIHYDRO1HPYRAZOL1YL)(THIOPHEN2YL)METHANONE
2CHLORO6ETHOXY3(3(4METHYLPHENYL)1(THIOPHEN2YLCARBONYL)45DIHYDRO1HPYRAZOL5YL)QUINOLINE
685135448
CCOC1=CC2=CC(=C(N=C2C=C1)Cl)C3CC(=NN3C(=O)C4=CC=CS4)C5=CC=C(C=C5)C
InChI=1SC26H22ClN3O2Sc13321910112118(1319)1420(25(27)2821)231522(178616(2)7917)2930(23)26(31)2454123324h41423H315H212H3
MFCD03666538
ZINC000009427326
ZINC000009638769

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Available files

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