Vitas-M small molecule compound

methyl 3-({[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL509403
SMILES COC(=O)c1cccc(c1)NC(=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/c1-12-15-8-3-4-9-16(15)22-19(20-12)26-11-17(23)21-14-7-5-6-13(10-14)18(24)25-2/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,21,23)
InChIKey
WBYCNXCDIAKFBZ-UHFFFAOYSA-N
Synonyms

2233857
InChI=1SC19H21N3O3Sc11215834916(15)2219(2012)261117(23)211475613(1014)18(24)252h5710H348911H212H3(H2123)
methyl3((((4methyl5678tetrahydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
methyl3((2((4methyl5678tetrahydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
MFCD05842325
ZINC000002881586
ZINC2881586

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Available files

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