Vitas-M small molecule compound

2-{[3-(3-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-cyclohexyl-N-methylacetamide

Catalog ID
STL060252
SMILES Clc1cccc(c1)Cn1c(SCC(=O)N(C2CCCCC2)C)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 C24H26ClN3O2S MW 456.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN3O2S/c1-27(19-10-3-2-4-11-19)22(29)16-31-24-26-21-13-6-5-12-20(21)23(30)28(24)15-17-8-7-9-18(25)14-17/h5-9,12-14,19H,2-4,10-11,15-16H2,1H3
InChIKey
XMIQGVFIRYHOAX-UHFFFAOYSA-N
Synonyms

2((3(3chlorobenzyl)4oxo34dihydroquinazolin2yl)sulfanyl)NcyclohexylNmethylacetamide
2(3((3chlorophenyl)methyl)4oxoquinazolin2yl)sulfanylNcyclohexylNmethylacetamide
CN(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC(=CC=C4)Cl
InChI=1SC24H26ClN3O2Sc127(19103241119)22(29)163124262113651220(21)23(30)28(24)151787918(25)1417h59121419H2410111516H21H3
MFCD18193490
ZINC000057472670
ZINC57472670

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Available files

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