Vitas-M small molecule compound

(2-chlorophenyl)[3-(3-methoxyphenyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]methanone

Catalog ID
STK856440
SMILES COc1cccc(c1)C1=NN(C(C1)c1cccs1)C(=O)c1ccccc1Cl

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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 C21H17ClN2O2S MW 396.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O2S/c1-26-15-7-4-6-14(12-15)18-13-19(20-10-5-11-27-20)24(23-18)21(25)16-8-2-3-9-17(16)22/h2-12,19H,13H2,1H3
InChIKey
RNZOHZBLIKWNBH-UHFFFAOYSA-N
Synonyms
701239-88-5
(2chlorophenyl)(3(3methoxyphenyl)5(thiophen2yl)45dihydro1Hpyrazol1yl)methanone
(2CHLOROPHENYL)(5(3METHOXYPHENYL)3THIOPHEN2YL34DIHYDROPYRAZOL2YL)METHANONE
701239885
COC1=CC=CC(=C1)C2=NN(C(C2)C3=CC=CS3)C(=O)C4=CC=CC=C4Cl
InChI=1SC21H17ClN2O2Sc1261574614(1215)181319(20105112720)24(2318)21(25)16823917(16)22h21219H13H21H3
MFCD03688411
ZINC000005055142
ZINC000005055143

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Available files

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