Vitas-M small molecule compound

4-{5-[(2-bromobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}aniline

Catalog ID
STK124713
SMILES CCn1c(nnc1c1ccc(cc1)N)SCc1ccccc1Br

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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 C17H17BrN4S MW 389.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN4S/c1-2-22-16(12-7-9-14(19)10-8-12)20-21-17(22)23-11-13-5-3-4-6-15(13)18/h3-10H,2,11,19H2,1H3
InChIKey
SYPUKUOVIXTWME-UHFFFAOYSA-N
Synonyms

4(5((2BROMOBENZYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ANILINE
4(5((2BROMOBENZYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)PHENYLAMINE
4(5((2BROMOPHENYL)METHYLSULFANYL)4ETHYL124TRIAZOL3YL)ANILINE
CCN1C(=NN=C1SCC2=CC=CC=C2Br)C3=CC=C(C=C3)N
InChI=1SC17H17BrN4Sc122216(127914(19)10812)202117(22)231113534615(13)18h310H21119H21H3
MFCD03864095
ZINC000002836144
ZINC02836144
ZINC2836144

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Available files

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