Vitas-M small molecule compound

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

Catalog ID
STL069799
SMILES CCCn1c(SCC(=O)Nc2ccccc2C(=O)OCC)nc2c(c1=O)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 C22H23N3O4S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4S/c1-3-13-25-20(27)15-9-5-7-11-17(15)24-22(25)30-14-19(26)23-18-12-8-6-10-16(18)21(28)29-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,23,26)
InChIKey
YMOMKOMJTMDLSB-UHFFFAOYSA-N
Synonyms

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3C(=O)OCC
ethyl2((((4oxo3propyl34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
ethyl2((2(4oxo3propylquinazolin2yl)sulfanylacetyl)amino)benzoate
InChI=1SC22H23N3O4Sc13132520(27)159571117(15)2422(25)301419(26)231812861016(18)21(28)2942h512H341314H212H3(H2326)
MFCD04502757
ZINC000057476811
ZINC57476811

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Available files

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