Vitas-M small molecule compound
2-[(2-chloro-4-fluorobenzyl)sulfanyl]-3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]quinazolin-4(3H)-one
Catalog ID
STL402519
SMILES Fc1ccc(c(c1)Cl)CSc1nc2ccccc2c(=O)n1CCCn1nc(cc1C)C
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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 C23H22ClFN4OS MW 456.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClFN4OS/c1-15-12-16(2)29(27-15)11-5-10-28-22(30)19-6-3-4-7-21(19)26-23(28)31-14-17-8-9-18(25)13-20(17)24/h3-4,6-9,12-13H,5,10-11,14H2,1-2H3InChIKey
DXILGPCCUWTQFS-UHFFFAOYSA-NSynonyms
1005590-24-81005590248
2((2chloro4fluorobenzyl)sulfanyl)3(3(35dimethyl1Hpyrazol1yl)propyl)quinazolin4(3H)one
2((2chloro4fluorophenyl)methylsulfanyl)3(3(35dimethylpyrazol1yl)propyl)quinazolin4one
CC1=CC(=NN1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=C(C=C4)F)Cl)C
InChI=1SC23H22ClFN4OSc1151216(2)29(2715)115102822(30)19634721(19)2623(28)3114178918(25)1320(17)24h34691213H5101114H212H3
MFCD06195505
ZINC000002740474
ZINC02740474
ZINC2740474
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