Vitas-M small molecule compound

6-(1-benzofuran-2-yl)-3-[(4-phenylpiperazin-1-yl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL112625
SMILES c1ccc(cc1)N1CCN(CC1)Cc1nnc2n1nc(s2)c1cc2c(o1)cccc2

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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 C22H20N6OS MW 416.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6OS/c1-2-7-17(8-3-1)27-12-10-26(11-13-27)15-20-23-24-22-28(20)25-21(30-22)19-14-16-6-4-5-9-18(16)29-19/h1-9,14H,10-13,15H2
InChIKey
BCTJWOFGVOZYLG-UHFFFAOYSA-N
Synonyms

6(1benzofuran2yl)3((4phenylpiperazin1yl)methyl)(124)triazolo(34b)(134)thiadiazole
C1CN(CCN1CC2=NN=C3N2N=C(S3)C4=CC5=CC=CC=C5O4)C6=CC=CC=C6
InChI=1SC22H20N6OSc12717(831)27121026(111327)152023242228(20)2521(3022)191416645918(16)2919h1914H101315H2
MFCD18485607
ZINC000065363286
ZINC65363286

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Available files

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