Vitas-M small molecule compound

3-(2-phenylethyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STK843405
SMILES c1ccc(cc1)CCc1nnc2n1cnc1c2c2CCCCc2s1

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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 C19H18N4S MW 334.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4S/c1-2-6-13(7-3-1)10-11-16-21-22-18-17-14-8-4-5-9-15(14)24-19(17)20-12-23(16)18/h1-3,6-7,12H,4-5,8-11H2
InChIKey
FXOSXLIETMQJTO-UHFFFAOYSA-N
Synonyms
442571-09-7
3(2phenylethyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidine
3phenethyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidine
442571097
C1CCC2=C(C1)C3=C(S2)N=CN4C3=NN=C4CCC5=CC=CC=C5
InChI=1SC19H18N4Sc12613(731)1011162122181714845915(14)2419(17)201223(16)18h136712H45811H2
MFCD02968030
ZINC000000098668
ZINC00098668
ZINC98668

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Available files

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