Vitas-M small molecule compound

6-tert-butyl-3-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STK555608
SMILES CC(C1=Nn2c(SC1)nnc2c1ccc(cc1)Cl)(C)C

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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 C14H15ClN4S MW 306.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15ClN4S/c1-14(2,3)11-8-20-13-17-16-12(19(13)18-11)9-4-6-10(15)7-5-9/h4-7H,8H2,1-3H3
InChIKey
XMZORNCVRIMUSE-UHFFFAOYSA-N
Synonyms
842961-72-2
6(tertbutyl)3(4chlorophenyl)7H(124)triazolo(34b)(134)thiadiazine
6(TERTBUTYL)3(4CHLOROPHENYL)7H124TRIAZOLO(34B)134THIADIAZINE
6tertbutyl3(4chlorophenyl)7H(124)triazolo(34b)(134)thiadiazine
842961722
CC(C)(C)C1=NN2C(=NN=C2SC1)C3=CC=C(C=C3)Cl
InChI=1SC14H15ClN4Sc114(23)1182013171612(19(13)1811)94610(15)759h47H8H213H3
MFCD04012349
ZINC000000526286
ZINC00526286
ZINC526286

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Available files

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