Vitas-M small molecule compound
2-[({4-(prop-2-en-1-yl)-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]quinazolin-4(3H)-one
Catalog ID
STK245725
SMILES C=CCn1c(COc2ccc3c(c2)CCCC3)nnc1SCc1nc2ccccc2c(=O)[nH]1
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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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-2-13-30-23(15-32-19-12-11-17-7-3-4-8-18(17)14-19)28-29-25(30)33-16-22-26-21-10-6-5-9-20(21)24(31)27-22/h2,5-6,9-12,14H,1,3-4,7-8,13,15-16H2,(H,26,27,31)InChIKey
SLBGLPXREQIXCQ-UHFFFAOYSA-NSynonyms
2(((4(prop2en1yl)5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)methyl)quinazolin4(3H)one
2((4prop2enyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanylmethyl)1Hquinazolin4one
C=CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)COC4=CC5=C(CCCC5)C=C4
C=CCn1c(COc2ccc3c(c2)CCCC3)nnc1SCc1nc2ccccc2c(=O)(nH)1
InChI=1SC25H25N5O2Sc12133023(153219121117734818(17)1419)282925(30)33162226211065920(21)24(31)2722h25691214H13478131516H2(H262731)
MFCD08670416
ZINC000009327925
ZINC09327925
ZINC9327925
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