Vitas-M small molecule compound

(4-bromo-5-ethylthiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone

Catalog ID
STK482531
SMILES CCc1sc(cc1Br)C(=O)N1CCCN(CC1)C

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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 C13H19BrN2OS MW 331.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19BrN2OS/c1-3-11-10(14)9-12(18-11)13(17)16-6-4-5-15(2)7-8-16/h9H,3-8H2,1-2H3
InChIKey
BCWNVPJVVCNIAJ-UHFFFAOYSA-N
Synonyms

(4bromo5ethylthiophen2yl)(4methyl14diazepan1yl)methanone
4BROMO5ETHYL(2THIENYL)4METHYL(14DIAZAPERHYDROEPINYL)KETONE
CCC1=C(C=C(S1)C(=O)N2CCCN(CC2)C)Br
InChI=1SC13H19BrN2OSc131110(14)912(1811)13(17)1664515(2)7816h9H38H212H3
MFCD08569974
ZINC000006741832
ZINC6741832

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Available files

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