Vitas-M small molecule compound

ethyl 2-({[(3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STL069738
SMILES CCOC(=O)c1ccccc1NC(=O)CSc1nc2ccccc2c(=O)n1C

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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 C20H19N3O4S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S/c1-3-27-19(26)14-9-5-7-11-16(14)21-17(24)12-28-20-22-15-10-6-4-8-13(15)18(25)23(20)2/h4-11H,3,12H2,1-2H3,(H,21,24)
InChIKey
PVZUZYQZUKCBDE-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C
ethyl2((((3methyl4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
ethyl2((2(3methyl4oxoquinazolin2yl)sulfanylacetyl)amino)benzoate
InChI=1SC20H19N3O4Sc132719(26)149571116(14)2117(24)12282022151064813(15)18(25)23(20)2h411H312H212H3(H2124)
MFCD05433591
ZINC000028606940
ZINC28606940

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Available files

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