Vitas-M small molecule compound

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

Catalog ID
STK445785
SMILES Fc1ccc(c(c1)Cl)CSCc1nnc(n1c1ccc(c(c1)Cl)F)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 C16H11Cl2F2N3S2 MW 418.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl2F2N3S2/c17-12-5-10(19)2-1-9(12)7-25-8-15-21-22-16(24)23(15)11-3-4-14(20)13(18)6-11/h1-6H,7-8H2,(H,22,24)
InChIKey
IGBGZCIRNRYVSY-UHFFFAOYSA-N
Synonyms

4(3chloro4fluorophenyl)3((2chloro4fluorophenyl)methylsulfanylmethyl)1H124triazole5thione
4(3CHLORO4FLUOROPHENYL)5(((2CHLORO4FLUOROPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
5(((2chloro4fluorobenzyl)sulfanyl)methyl)4(3chloro4fluorophenyl)4H124triazole3thiol
C1=CC(=C(C=C1N2C(=NNC2=S)CSCC3=C(C=C(C=C3)F)Cl)Cl)F
InChI=1SC16H11Cl2F2N3S2c1712510(19)219(12)725815212216(24)23(15)113414(20)13(18)611h16H78H2(H2224)
MFCD04058291
ZINC000017091349
ZINC17091349

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Available files

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