Vitas-M small molecule compound

azepan-1-yl(5-methylthiophen-2-yl)methanone

Catalog ID
STK492374
SMILES O=C(c1ccc(s1)C)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 C12H17NOS MW 223.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NOS/c1-10-6-7-11(15-10)12(14)13-8-4-2-3-5-9-13/h6-7H,2-5,8-9H2,1H3
InChIKey
BEPLXNDKFWNGCH-UHFFFAOYSA-N
Synonyms

1(5METHYLTHIOPHENE2CARBONYL)AZEPANE
AZAPERHYDROEPINYL5METHYL(2THIENYL)KETONE
azepan1yl(5methylthiophen2yl)methanone
CC1=CC=C(S1)C(=O)N2CCCCCC2
InChI=1SC12H17NOSc1106711(1510)12(14)1384235913h67H2589H21H3
MFCD09873558
ZINC000016606114
ZINC16606114

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Available files

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