Vitas-M small molecule compound

3-iodo-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]benzamide

Catalog ID
STK345400
SMILES Ic1cccc(c1)C(=O)NCc1ccc(cc1)c1nn2c(s1)nnc2

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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 C17H12IN5OS MW 461.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12IN5OS/c18-14-3-1-2-13(8-14)15(24)19-9-11-4-6-12(7-5-11)16-22-23-10-20-21-17(23)25-16/h1-8,10H,9H2,(H,19,24)
InChIKey
CHJNSBWRJZWYGM-UHFFFAOYSA-N
Synonyms

3iodoN((4((124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)benzamide
3iodoN(4((124)triazolo(34b)(134)thiadiazol6yl)benzyl)benzamide
3IODON(4(124)TRIAZOLO(34B)(134)THIADIAZOL6YLBENZYL)BENZAMIDE
C1=CC(=CC(=C1)I)C(=O)NCC2=CC=C(C=C2)C3=NN4C=NN=C4S3
InChI=1SC17H12IN5OSc181431213(814)15(24)199114612(7511)16222310202117(23)2516h1810H9H2(H1924)
MFCD09965092
ZINC000012857112
ZINC12857112

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Available files

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