Vitas-M small molecule compound

N-benzyl-2-[(2-ethyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide

Catalog ID
STL004376
SMILES CCc1nc(SCC(=O)NCc2ccccc2)c2c(n1)c1ccccc1o2

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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 C21H19N3O2S MW 377.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S/c1-2-17-23-19-15-10-6-7-11-16(15)26-20(19)21(24-17)27-13-18(25)22-12-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,22,25)
InChIKey
UMIZEQCDCXWFIR-UHFFFAOYSA-N
Synonyms
861138-51-4
861138514
CCC1=NC2=C(C(=N1)SCC(=O)NCC3=CC=CC=C3)OC4=CC=CC=C42
InChI=1SC21H19N3O2Sc121723191510671116(15)2620(19)21(2417)271318(25)2212148435914h311H21213H21H3(H2225)
MFCD05683666
Nbenzyl2((2ethyl(1)benzofuro(32d)pyrimidin4yl)sulfanyl)acetamide
Nbenzyl2((2ethylbenzofuro(32d)pyrimidin4yl)thio)acetamide
ZINC000005478075
ZINC05478075
ZINC5478075

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Available files

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