Vitas-M small molecule compound

4-butoxy-N-[3-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide

Catalog ID
STK390962
SMILES CCCCOc1ccc(cc1)C(=O)Nc1cccc(c1)c1nn2c(s1)nnc2C

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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-3-4-12-28-18-10-8-15(9-11-18)19(27)22-17-7-5-6-16(13-17)20-25-26-14(2)23-24-21(26)29-20/h5-11,13H,3-4,12H2,1-2H3,(H,22,27)
InChIKey
HLLDIEVWAGHEPU-UHFFFAOYSA-N
Synonyms

4butoxyN(3(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)benzamide
CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN4C(=NN=C4S3)C
InChI=1SC21H21N5O2Sc13412281810815(91118)19(27)221775616(1317)20252614(2)232421(26)2920h51113H3412H212H3(H2227)
MFCD05740190
ZINC000002181801
ZINC02181801
ZINC2181801

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Available files

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