Vitas-M small molecule compound

4-fluoro-N-(6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)benzamide

Catalog ID
STL284539
SMILES Fc1ccc(cc1)C(=O)Nc1ncnc2c1c1CCCCCc1s2

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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 C18H16FN3OS MW 341.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FN3OS/c19-12-8-6-11(7-9-12)17(23)22-16-15-13-4-2-1-3-5-14(13)24-18(15)21-10-20-16/h6-10H,1-5H2,(H,20,21,22,23)
InChIKey
CBZBMUDELIVGRR-UHFFFAOYSA-N
Synonyms
461429-40-3
461429403
4fluoroN(6789tetrahydro5Hcyclohepta(45)thieno(12c)pyrimidin4yl)benzamide
4fluoroN(6789tetrahydro5Hcyclohepta(45)thieno(23d)pyrimidin4yl)benzamide
C1CCC2=C(CC1)SC3=NC=NC(=C23)NC(=O)C4=CC=C(C=C4)F
InChI=1SC18H16FN3OSc19128611(7912)17(23)221615134213514(13)2418(15)21102016h610H15H2(H20212223)
MFCD03246821
ZINC000000546124
ZINC00546124
ZINC546124

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Available files

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