Vitas-M small molecule compound

3-benzyl-2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STL367248
SMILES Cc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3

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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 C18H18N2OS MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS/c1-12-19-17-16(14-9-5-6-10-15(14)22-17)18(21)20(12)11-13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-11H2,1H3
InChIKey
QSGMEISBFXSSOU-UHFFFAOYSA-N
Synonyms
35973-85-4
35973854
3BENZYL2METHYL4OXO56TETRAMETHYLENETHIENO(23D)PYRIMIDINE
3benzyl2methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3benzyl2methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4=CC=CC=C4
InChI=1SC18H18N2OSc112191716(149561015(14)2217)18(21)20(12)11137324813h2478H56911H21H3
MFCD00409486
ZINC000000301154
ZINC00301154
ZINC301154

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Available files

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