Vitas-M small molecule compound

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

Catalog ID
STK913446
SMILES Cc1ccc(cc1)OCc1nn2c(s1)nnc2c1ccccn1

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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 C16H13N5OS MW 323.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5OS/c1-11-5-7-12(8-6-11)22-10-14-20-21-15(18-19-16(21)23-14)13-4-2-3-9-17-13/h2-9H,10H2,1H3
InChIKey
YXNWXLKYQAMHAR-UHFFFAOYSA-N
Synonyms
862199-66-4
2(6(4METHYLPHENOXYMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL3YL)PYRIDINE
3(pyridin2yl)6((ptolyloxy)methyl)(124)triazolo(34b)(134)thiadiazole
4METHYL1((3(2PYRIDYL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))METHOXY)BENZENE
6((4METHYLPHENOXY)METHYL)3(2PYRIDINYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6((4methylphenoxy)methyl)3(pyridin2yl)(124)triazolo(34b)(134)thiadiazole
6((4METHYLPHENOXY)METHYL)3PYRIDIN2YL(124)TRIAZOLO(34B)(134)THIADIAZOLE
862199664
CC1=CC=C(C=C1)OCC2=NN3C(=NN=C3S2)C4=CC=CC=N4
InChI=1SC16H13N5OSc1115712(8611)221014202115(181916(21)2314)1342391713h29H10H21H3
MFCD05697233
ZINC000005554470
ZINC05554470
ZINC5554470

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Available files

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