Vitas-M small molecule compound

2-[(2-chloro-6-fluorobenzyl)sulfanyl]-3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]quinazolin-4(3H)-one

Catalog ID
STK314294
SMILES Cc1cc(n(n1)CCCn1c(SCc2c(F)cccc2Cl)nc2c(c1=O)cccc2)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/c1-15-13-16(2)29(27-15)12-6-11-28-22(30)17-7-3-4-10-21(17)26-23(28)31-14-18-19(24)8-5-9-20(18)25/h3-5,7-10,13H,6,11-12,14H2,1-2H3
InChIKey
MINURQZESZLXEP-UHFFFAOYSA-N
Synonyms
1005588-54-4
1005588544
2((2chloro6fluorobenzyl)sulfanyl)3(3(35dimethyl1Hpyrazol1yl)propyl)quinazolin4(3H)one
2((2chloro6fluorophenyl)methylsulfanyl)3(3(35dimethylpyrazol1yl)propyl)quinazolin4one
CC1=CC(=NN1CCCN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC=C4Cl)F)C
InChI=1SC23H22ClFN4OSc1151316(2)29(2715)126112822(30)177341021(17)2623(28)31141819(24)85920(18)25h3571013H6111214H212H3
MFCD05667640
ZINC000002733649
ZINC02733649
ZINC2733649

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Available files

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