Vitas-M small molecule compound
2-(3-butoxyphenyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]
Catalog ID
STK557013
SMILES CCCCOc1cccc(c1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCC2
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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 C27H28N4O MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O/c1-2-3-15-32-21-11-8-10-19(16-21)25-29-26-23-24(28-18-31(26)30-25)22-12-5-4-9-20(22)17-27(23)13-6-7-14-27/h4-5,8-12,16,18H,2-3,6-7,13-15,17H2,1H3InChIKey
DZXOQOBGQVPZMR-UHFFFAOYSA-NSynonyms
577985-68-32(3butoxyphenyl)5Hspiro(benzo(h)(124)triazolo(15c)quinazoline41cyclopentane)
577985683
CCCCOC1=CC=CC(=C1)C2=NN3C=NC4=C(C3=N2)C5(CCCC5)CC6=CC=CC=C64
InChI=1SC27H28N4Oc1231532211181019(1621)2529262324(281831(26)3025)221254920(22)1727(23)13671427h458121618H2367131517H21H3
MFCD04022091
ZINC000002348963
ZINC02348963
ZINC2348963
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