Vitas-M small molecule compound

1-amino-N-(3,4-dichlorophenyl)-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide

Catalog ID
STK027559
SMILES CCc1nc2sc(c(c2c2c1CCCC2)N)C(=O)Nc1ccc(c(c1)Cl)Cl

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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 C20H19Cl2N3OS MW 420.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Cl2N3OS/c1-2-15-11-5-3-4-6-12(11)16-17(23)18(27-20(16)25-15)19(26)24-10-7-8-13(21)14(22)9-10/h7-9H,2-6,23H2,1H3,(H,24,26)
InChIKey
CQKSZOBZLMLYLW-UHFFFAOYSA-N
Synonyms
371922-40-6
1aminoN(34dichlorophenyl)5ethyl6789tetrahydrothieno(23c)isoquinoline2carboxamide
371922406
CCC1=C2CCCCC2=C3C(=C(SC3=N1)C(=O)NC4=CC(=C(C=C4)Cl)Cl)N
CCc1nc2sc(c(c2c2c1CCCC2)N)C(=O)Nc1ccc(c(c1)Cl)Cl
InChI=1SC20H19Cl2N3OSc121511534612(11)1617(23)18(2720(16)2515)19(26)24107813(21)14(22)910h79H2623H21H3(H2426)
MFCD03007101
STK027559
ZINC000001246889
ZINC01246889
ZINC1246889

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Available files

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