Vitas-M small molecule compound

(4Z)-4-[2-(2,5-dichlorophenyl)hydrazinylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide

Catalog ID
STK084981
SMILES Clc1ccc(c(c1)N/N=C\1/C(=NN(C1=O)C(=S)N)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 C11H9Cl2N5OS MW 330.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9Cl2N5OS/c1-5-9(10(19)18(17-5)11(14)20)16-15-8-4-6(12)2-3-7(8)13/h2-4,15H,1H3,(H2,14,20)/b16-9-
InChIKey
PCQKUBCQWLSEKB-SXGWCWSVSA-N
Synonyms

(4Z)4((25DICHLOROPHENYL)HYDRAZINYLIDENE)3METHYL5OXOPYRAZOLE1CARBOTHIOAMIDE
(4Z)4(2(25DICHLOROPHENYL)HYDRAZINYLIDENE)3METHYL5OXO45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
1(AMINOTHIOXOMETHYL)4(((25DICHLOROPHENYL)AMINO)AZAMETHYLENE)3METHYL12DIAZOLIN5ONE
1HPYRAZOLE1CARBOTHIOAMIDE4(2(25DICHLOROPHENYL)HYDRAZINYLIDENE)45DIHYDRO3METHYL5OXO
CC1=NN(C(=O)C1=NNC2=C(C=CC(=C2)Cl)Cl)C(=S)N
Clc1ccc(c(c1)NN=C1C(=NN(C1=O)C(=S)N)C)Cl
InChI=1SC11H9Cl2N5OSc159(10(19)18(175)11(14)20)1615846(12)237(8)13h2415H1H3(H21420)b169
MFCD02026013
STK084981
ZINC000100005894
ZINC96515537

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Available files

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