Vitas-M small molecule compound

3-(4-butoxyphenyl)-4-methyl-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK484148
SMILES CCCCOc1ccc(cc1)c1nnc(n1C)SCc1ccccc1C

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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 C21H25N3OS MW 367.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3OS/c1-4-5-14-25-19-12-10-17(11-13-19)20-22-23-21(24(20)3)26-15-18-9-7-6-8-16(18)2/h6-13H,4-5,14-15H2,1-3H3
InChIKey
UUVWJBQMQUGVNW-UHFFFAOYSA-N
Synonyms

3(4butoxyphenyl)4methyl5((2methylbenzyl)sulfanyl)4H124triazole
3(4butoxyphenyl)4methyl5((2methylphenyl)methylsulfanyl)124triazole
4BUTOXY1(4METHYL5((2METHYLPHENYL)METHYLTHIO)(124TRIAZOL3YL))BENZENE
CCCCOC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC=CC=C3C
InChI=1SC21H25N3OSc145142519121017(111319)20222321(24(20)3)261518976816(18)2h613H451415H213H3
MFCD07063929
ZINC000013325574
ZINC13325574

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Available files

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