Vitas-M small molecule compound

3-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine

Catalog ID
STL300205
SMILES C1CSc2n(CC1)c(nn2)c1ccccc1

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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 C12H13N3S MW 231.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3S/c1-2-6-10(7-3-1)11-13-14-12-15(11)8-4-5-9-16-12/h1-3,6-7H,4-5,8-9H2
InChIKey
UGLZULDSDHPKNH-UHFFFAOYSA-N
Synonyms
947865-75-0
3phenyl5678tetrahydro(124)triazolo(34b)(13)thiazepine
947865750
C1CCSC2=NN=C(N2C1)C3=CC=CC=C3
InChI=1SC12H13N3Sc12610(731)1113141215(11)84591612h1367H4589H2
MFCD09184931
ZINC000010312536
ZINC10312536

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Available files

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