Vitas-M small molecule compound

(4E)-4-[2-(naphthalen-1-yl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide

Catalog ID
STK099987
SMILES NC(=S)N1N=C(/C(=N\Nc2cccc3c2cccc3)/C1=O)c1ccccc1

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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 C20H15N5OS MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N5OS/c21-20(27)25-19(26)18(17(24-25)14-8-2-1-3-9-14)23-22-16-12-6-10-13-7-4-5-11-15(13)16/h1-12,22H,(H2,21,27)/b23-18+
InChIKey
QYXFUHVMKRFUIM-PTGBLXJZSA-N
Synonyms

(4E)4(2(NAPHTHALEN1YL)HYDRAZINYLIDENE)5OXO3PHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
(4E)4(naphthalen1ylhydrazinylidene)5oxo3phenylpyrazole1carbothioamide
1(AMINOTHIOXOMETHYL)4((NAPHTHYLAMINO)AZAMETHYLENE)3PHENYL12DIAZOLIN5ONE
4(NAPHTHALEN1YLHYDRAZONO)5OXO3PHENYL45DIHYDROPYRAZOLE1CARBOTHIOIC
C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=CC4=CC=CC=C43)C(=S)N
InChI=1SC20H15N5OSc2120(27)2519(26)18(17(2425)148213914)23221612610137451115(13)16h11222H(H22127)b2318+
MFCD01078264
NC(=S)N1N=C(C(=NNc2cccc3c2cccc3)C1=O)c1ccccc1
STK099987
ZINC000100512806
ZINC05528228
ZINC5528228

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Available files

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