Vitas-M small molecule compound

3-[(2-chlorobenzyl)sulfanyl]-5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazole

Catalog ID
STK735645
SMILES Clc1ccccc1CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C1CCCCC1

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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 C28H28ClN3OS MW 490.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3OS/c29-26-14-8-7-11-23(26)20-34-28-31-30-27(32(28)24-12-5-2-6-13-24)19-33-25-17-15-22(16-18-25)21-9-3-1-4-10-21/h2,5-8,11-18,21H,1,3-4,9-10,19-20H2
InChIKey
LRIGFVMVOUISOG-UHFFFAOYSA-N
Synonyms
348593-07-7
3((2chlorobenzyl)sulfanyl)5((4cyclohexylphenoxy)methyl)4phenyl4H124triazole
3((2chlorobenzyl)thio)5((4cyclohexylphenoxy)methyl)4phenyl4H124triazole
3((2CHLOROPHENYL)METHYLSULFANYL)5((4CYCLOHEXYLPHENOXY)METHYL)4PHENYL124TRIAZOLE
348593077
C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(N3C4=CC=CC=C4)SCC5=CC=CC=C5Cl
InChI=1SC28H28ClN3OSc292614871123(26)203428313027(32(28)24125261324)193325171522(161825)2193141021h258111821H1349101920H2
MFCD01204108
ZINC000002328424
ZINC02328424
ZINC2328424

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Available files

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