Vitas-M small molecule compound

5-{[(2-chloro-4-fluorobenzyl)sulfanyl]methyl}-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK445833
SMILES Fc1ccc(c(c1)Cl)CSCc1nnc(n1c1cccc2c1cccc2)S

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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 C20H15ClFN3S2 MW 415.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClFN3S2/c21-17-10-15(22)9-8-14(17)11-27-12-19-23-24-20(26)25(19)18-7-3-5-13-4-1-2-6-16(13)18/h1-10H,11-12H2,(H,24,26)
InChIKey
YUDKOBWIKCAFJC-UHFFFAOYSA-N
Synonyms

3((2chloro4fluorophenyl)methylsulfanylmethyl)4naphthalen1yl1H124triazole5thione
5(((2chloro4fluorobenzyl)sulfanyl)methyl)4(naphthalen1yl)4H124triazole3thiol
5(((2CHLORO4FLUOROPHENYL)METHYLTHIO)METHYL)4NAPHTHYL124TRIAZOLE3THIOL
C1=CC=C2C(=C1)C=CC=C2N3C(=NNC3=S)CSCC4=C(C=C(C=C4)F)Cl
InChI=1SC20H15ClFN3S2c21171015(22)9814(17)11271219232420(26)25(19)1873513412616(13)18h110H1112H2(H2426)
MFCD04058514
ZINC000017090448
ZINC17090448

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Available files

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