Vitas-M small molecule compound

azepan-1-yl(biphenyl-4-yl)methanethione

Catalog ID
STK221352
SMILES S=C(c1ccc(cc1)c1ccccc1)N1CCCCCC1

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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 C19H21NS MW 295.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NS/c21-19(20-14-6-1-2-7-15-20)18-12-10-17(11-13-18)16-8-4-3-5-9-16/h3-5,8-13H,1-2,6-7,14-15H2
InChIKey
IMIDCLPYXBQVGB-UHFFFAOYSA-N
Synonyms
676475-62-0
676475620
AZEPAN1YL(4PHENYLPHENYL)METHANETHIONE
azepan1yl(biphenyl4yl)methanethione
C1CCCN(CC1)C(=S)C2=CC=C(C=C2)C3=CC=CC=C3
InChI=1SC19H21NSc2119(201461271520)18121017(111318)168435916h35813H12671415H2
MFCD08681960
ZINC000004815987
ZINC04815987
ZINC4815987

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Available files

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