Vitas-M small molecule compound

methyl 2-({[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL505154
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc(C)c2c(n1)CCCC2

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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 C19H21N3O3S MW 371.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O3S/c1-12-13-7-3-5-9-15(13)22-19(20-12)26-11-17(23)21-16-10-6-4-8-14(16)18(24)25-2/h4,6,8,10H,3,5,7,9,11H2,1-2H3,(H,21,23)
InChIKey
LYIIFSCSVGEDBW-UHFFFAOYSA-N
Synonyms

126280008
InChI=1SC19H21N3O3Sc11213735915(13)2219(2012)261117(23)21161064814(16)18(24)252h46810H357911H212H3(H2123)
methyl2((((4methyl5678tetrahydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((4methyl5678tetrahydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
MFCD05843040
ZINC000409273845
ZINC409273845

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Available files

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