Vitas-M small molecule compound
2-{[(4-ethyl-5-{[(1-methylnaphthalen-2-yl)oxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Catalog ID
STK232356
SMILES CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1COc1ccc2c(c1C)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 C25H23N5O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S/c1-3-30-23(14-32-21-13-12-17-8-4-5-9-18(17)16(21)2)28-29-25(30)33-15-22-26-20-11-7-6-10-19(20)24(31)27-22/h4-13H,3,14-15H2,1-2H3,(H,26,27,31)InChIKey
GFUYRAKVTGATGE-UHFFFAOYSA-NSynonyms
2(((4ETHYL5(((1METHYLNAPHTHALEN2YL)OXY)METHYL)4H124TRIAZOL3YL)SULFANYL)METHYL)QUINAZOLIN4(3H)ONE
2((4ETHYL5((1METHYLNAPHTHALEN2YL)OXYMETHYL)124TRIAZOL3YL)SULFANYLMETHYL)1HQUINAZOLIN4ONE
CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)COC4=C(C5=CC=CC=C5C=C4)C
CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1COc1ccc2c(c1C)cccc2
InChI=1SC25H23N5O2Sc133023(143221131217845918(17)16(21)2)282925(30)331522262011761019(20)24(31)2722h413H31415H212H3(H262731)
MFCD06627636
ZINC000018222543
ZINC18222543
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