Vitas-M small molecule compound

3-amino-N-(2-phenylethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide

Catalog ID
STK770069
SMILES O=C(c1sc2c(c1N)cc1c(n2)CCCCC1)NCCc1ccccc1

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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 C21H23N3OS MW 365.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3OS/c22-18-16-13-15-9-5-2-6-10-17(15)24-21(16)26-19(18)20(25)23-12-11-14-7-3-1-4-8-14/h1,3-4,7-8,13H,2,5-6,9-12,22H2,(H,23,25)
InChIKey
XPJJCSTTZVLKTC-UHFFFAOYSA-N
Synonyms

3aminoN(2phenylethyl)6789tetrahydro5Hcyclohepta(b)thieno(32e)pyridine2carboxamide
C1CCC2=C(CC1)N=C3C(=C2)C(=C(S3)C(=O)NCCC4=CC=CC=C4)N
InChI=1SC21H23N3OSc221816131595261017(15)2421(16)2619(18)20(25)231211147314814h1347813H25691222H2(H2325)
MFCD03081512
ZINC000001072355
ZINC01072355
ZINC1072355

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Available files

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