Vitas-M small molecule compound

3-({[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4,5-diethyl-4H-1,2,4-triazole

Catalog ID
STK463614
SMILES CCc1nnc(n1CC)SCc1csc(n1)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 C16H17ClN4S2 MW 364.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4S2/c1-3-14-19-20-16(21(14)4-2)23-10-11-9-22-15(18-11)12-7-5-6-8-13(12)17/h5-9H,3-4,10H2,1-2H3
InChIKey
JFYNXKXXAPJFPA-UHFFFAOYSA-N
Synonyms

2(2chlorophenyl)4((45diethyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(2chlorophenyl)13thiazol4yl)methyl)sulfanyl)45diethyl4H124triazole
5((2(2CHLOROPHENYL)(13THIAZOL4YL))METHYLTHIO)34DIETHYL124TRIAZOLE
CCC1=NN=C(N1CC)SCC2=CSC(=N2)C3=CC=CC=C3Cl
InChI=1SC16H17ClN4S2c1314192016(21(14)42)23101192215(1811)12756813(12)17h59H3410H212H3
MFCD05121580
ZINC000017075010
ZINC17075010

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Available files

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