Vitas-M small molecule compound

1-[5-(1,3-benzodioxol-5-yl)-3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone

Catalog ID
STK922213
SMILES CC(=O)N1N=C(CC1c1ccc2c(c1)OCO2)c1ccc(c(c1)Cl)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 C18H14Cl2N2O3 MW 377.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2N2O3/c1-10(23)22-16(12-3-5-17-18(7-12)25-9-24-17)8-15(21-22)11-2-4-13(19)14(20)6-11/h2-7,16H,8-9H2,1H3
InChIKey
YHSRRZJFGNQJBT-UHFFFAOYSA-N
Synonyms

1(3(13benzodioxol5yl)5(34dichlorophenyl)34dihydropyrazol2yl)ethanone
1(5(13benzodioxol5yl)3(34dichlorophenyl)45dihydro1Hpyrazol1yl)ethanone
5(2HBENZO(34D)13DIOXOLEN5YL)1ACETYL3(34DICHLOROPHENYL)2PYRAZOLINE
CC(=O)N1C(CC(=N1)C2=CC(=C(C=C2)Cl)Cl)C3=CC4=C(C=C3)OCO4
InChI=1SC18H14Cl2N2O3c110(23)2216(12351718(712)2592417)815(2122)112413(19)14(20)611h2716H89H21H3
MFCD11225234
ZINC000016139033
ZINC000016139035

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Available files

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