Vitas-M small molecule compound

methyl 4-[(quinazolin-4-ylsulfanyl)methyl]benzoate

Catalog ID
STL226834
SMILES COC(=O)c1ccc(cc1)CSc1ncnc2c1cccc2

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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 C17H14N2O2S MW 310.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O2S/c1-21-17(20)13-8-6-12(7-9-13)10-22-16-14-4-2-3-5-15(14)18-11-19-16/h2-9,11H,10H2,1H3
InChIKey
AJESGJIWNHDOMN-UHFFFAOYSA-N
Synonyms
737820-45-0
737820450
COC(=O)C1=CC=C(C=C1)CSC2=NC=NC3=CC=CC=C32
InChI=1SC17H14N2O2Sc12117(20)138612(7913)10221614423515(14)18111916h2911H10H21H3
methyl4((quinazolin4ylsulfanyl)methyl)benzoate
METHYL4(QUINAZOLIN4YLSULFANYLMETHYL)BENZOATE
MFCD03984114
ZINC000003251868
ZINC03251868
ZINC3251868

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Available files

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