Vitas-M small molecule compound

N-(3-methoxyphenyl)azepane-1-carbothioamide

Catalog ID
STK489949
SMILES COc1cccc(c1)NC(=S)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 C14H20N2OS MW 264.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N2OS/c1-17-13-8-6-7-12(11-13)15-14(18)16-9-4-2-3-5-10-16/h6-8,11H,2-5,9-10H2,1H3,(H,15,18)
InChIKey
JVFZLKINSPFNRW-UHFFFAOYSA-N
Synonyms

AZAPERHYDROEPINYL((3METHOXYPHENYL)AMINO)METHANE1THIONE
COC1=CC=CC(=C1)NC(=S)N2CCCCCC2
InChI=1SC14H20N2OSc1171386712(1113)1514(18)16942351016h6811H25910H21H3(H1518)
MFCD03493382
N(3methoxyphenyl)azepane1carbothioamide
ZINC000007522251
ZINC07522251
ZINC7522251

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Available files

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