Vitas-M small molecule compound

3-(pyridin-3-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine

Catalog ID
STK708489
SMILES C1CSc2n(CC1)c(nn2)c1cccnc1

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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 C11H12N4S MW 232.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4S/c1-2-7-16-11-14-13-10(15(11)6-1)9-4-3-5-12-8-9/h3-5,8H,1-2,6-7H2
InChIKey
FTEVTVLWPYPZNI-UHFFFAOYSA-N
Synonyms
947866-28-6
3(pyridin3yl)5678tetrahydro(124)triazolo(34b)(13)thiazepine
3pyridin3yl5678tetrahydro(124)triazolo(34b)(13)thiazepine
947866286
C1CCSC2=NN=C(N2C1)C3=CN=CC=C3
InChI=1SC11H12N4Sc1271611141310(15(11)61)94351289h358H1267H2
MFCD09185009
ZINC000010312612
ZINC10312612

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Available files

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