Vitas-M small molecule compound
3-{5-[(4-bromobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK202338
SMILES CCn1c(SCc2ccc(cc2)Br)nnc1c1cccc(c1)N
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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(13-4-3-5-15(19)10-13)20-21-17(22)23-11-12-6-8-14(18)9-7-12/h3-10H,2,11,19H2,1H3InChIKey
NELSWOPHZDUZHP-UHFFFAOYSA-NSynonyms
3(5((4BROMOBENZYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ANILINE
3(5((4BROMOPHENYL)METHYLSULFANYL)4ETHYL124TRIAZOL3YL)ANILINE
CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC(=CC=C3)N
InChI=1SC17H17BrN4Sc122216(1343515(19)1013)202117(22)2311126814(18)9712h310H21119H21H3
MFCD04347024
ZINC000001112559
ZINC01112559
ZINC1112559
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