Vitas-M small molecule compound

(3-amino-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl)(4-methoxyphenyl)methanone

Catalog ID
STK547772
SMILES COc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CCCCC1

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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 C20H20N2O2S MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O2S/c1-24-14-9-7-12(8-10-14)18(23)19-17(21)15-11-13-5-3-2-4-6-16(13)22-20(15)25-19/h7-11H,2-6,21H2,1H3
InChIKey
VNMKCSPZHMZDBT-UHFFFAOYSA-N
Synonyms
445385-16-0
(3amino6789tetrahydro5Hcyclohepta(b)thieno(32e)pyridin2yl)(4methoxyphenyl)methanone
445385160
COC1=CC=C(C=C1)C(=O)C2=C(C3=CC4=C(CCCCC4)N=C3S2)N
InChI=1SC20H20N2O2Sc124149712(81014)18(23)1917(21)1511135324616(13)2220(15)2519h711H2621H21H3
MFCD03076012
ZINC000000663649
ZINC00663649
ZINC663649

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Available files

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