Vitas-M small molecule compound

2-(pyridin-3-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STK394949
SMILES O=C1NC(Nc2c1c1CCCCc1s2)c1cccnc1

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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 C15H15N3OS MW 285.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3OS/c19-14-12-10-5-1-2-6-11(10)20-15(12)18-13(17-14)9-4-3-7-16-8-9/h3-4,7-8,13,18H,1-2,5-6H2,(H,17,19)
InChIKey
QGNIRTPKSCJSJT-UHFFFAOYSA-N
Synonyms
312697-74-8
2(pyridin3yl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
2pyridin3yl235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
312697748
C1CCC2=C(C1)C3=C(S2)NC(NC3=O)C4=CN=CC=C4
InChI=1SC15H15N3OSc19141210512611(10)2015(12)1813(1714)94371689h34781318H1256H2(H1719)
MFCD00570242
ZINC000000565682
ZINC000000565683
ZINC00565682
ZINC00565683

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Available files

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