Vitas-M small molecule compound
4-(4-chlorobenzyl)-5-[phenyl(phenylsulfanyl)methyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448381
SMILES Clc1ccc(cc1)Cn1c(S)nnc1C(c1ccccc1)Sc1ccccc1
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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 C22H18ClN3S2 MW 423.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3S2/c23-18-13-11-16(12-14-18)15-26-21(24-25-22(26)27)20(17-7-3-1-4-8-17)28-19-9-5-2-6-10-19/h1-14,20H,15H2,(H,25,27)InChIKey
XHRAWGSZYAOKQC-UHFFFAOYSA-NSynonyms
4((4chlorophenyl)methyl)3(phenyl(phenylsulfanyl)methyl)1H124triazole5thione
4((4CHLOROPHENYL)METHYL)5(PHENYLPHENYLTHIOMETHYL)124TRIAZOLE3THIOL
4(4chlorobenzyl)5(phenyl(phenylsulfanyl)methyl)4H124triazole3thiol
C1=CC=C(C=C1)C(C2=NNC(=S)N2CC3=CC=C(C=C3)Cl)SC4=CC=CC=C4
InChI=1SC22H18ClN3S2c2318131116(121418)152621(242522(26)27)20(177314817)281995261019h11420H15H2(H2527)
MFCD04140839
ZINC000017093754
ZINC000017093755
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