Vitas-M small molecule compound

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

Catalog ID
STL284538
SMILES O=C(c1ccccc1)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 C18H17N3OS MW 323.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3OS/c22-17(12-7-3-1-4-8-12)21-16-15-13-9-5-2-6-10-14(13)23-18(15)20-11-19-16/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,19,20,21,22)
InChIKey
BKCLCCAXJXPQSI-UHFFFAOYSA-N
Synonyms
461430-02-4
461430024
C1CCC2=C(CC1)SC3=NC=NC(=C23)NC(=O)C4=CC=CC=C4
InChI=1SC18H17N3OSc2217(127314812)2116151395261014(13)2318(15)20111916h1347811H256910H2(H19202122)
MFCD03247170
N(6789tetrahydro5Hcyclohepta(45)thieno(12c)pyrimidin4yl)benzamide
N(6789tetrahydro5Hcyclohepta(45)thieno(23d)pyrimidin4yl)benzamide
ZINC000000538659
ZINC00538659
ZINC538659

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Available files

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