Vitas-M small molecule compound

N-(3-bromophenyl)-2-[(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide

Catalog ID
STK929499
SMILES O=C(Nc1cccc(c1)Br)CSc1ccc2n(n1)c(C)nn2

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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 C14H12BrN5OS MW 378.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrN5OS/c1-9-17-18-12-5-6-14(19-20(9)12)22-8-13(21)16-11-4-2-3-10(15)7-11/h2-7H,8H2,1H3,(H,16,21)
InChIKey
XSGMHXXMAPAAFE-UHFFFAOYSA-N
Synonyms
1232790-31-6
1232790316
CC1=NN=C2N1N=C(C=C2)SCC(=O)NC3=CC(=CC=C3)Br
InChI=1SC14H12BrN5OSc191718125614(1920(9)12)22813(21)161142310(15)711h27H8H21H3(H1621)
MFCD18069540
N(3bromophenyl)2((3methyl(124)triazolo(43b)pyridazin6yl)sulfanyl)acetamide
N(3bromophenyl)2((3methyl(124)triazolo(43b)pyridazin6yl)thio)acetamide
ZINC000044890205
ZINC44890205

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.