Vitas-M small molecule compound

5-amino-3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl thiocyanate

Catalog ID
STL560590
SMILES N#CSc1c(nn(c1N)c1ccccc1)c1ccc(cc1)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 C16H11ClN4S MW 326.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN4S/c17-12-8-6-11(7-9-12)14-15(22-10-18)16(19)21(20-14)13-4-2-1-3-5-13/h1-9H,19H2
InChIKey
SYIWKADWQXMMQP-UHFFFAOYSA-N
Synonyms

(5amino3(4chlorophenyl)1phenylpyrazol4yl)thiocyanate
555910
5amino3(4chlorophenyl)1phenyl1Hpyrazol4ylthiocyanate
InChI=1SC16H11ClN4Sc17128611(7912)1415(221018)16(19)21(2014)134213513h19H19H2
MFCD32220521
PYRAZOL5AMINE3(4CHLOROPHENYL)1PHENYL4THIOCYANATO
ZINC000032224795

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Available files

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