Vitas-M small molecule compound
2-(3-butoxyphenyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Catalog ID
STK555220
SMILES CCCCOc1cccc(c1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2
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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 C28H30N4O MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O/c1-2-3-16-33-22-12-9-11-20(17-22)26-30-27-24-25(29-19-32(27)31-26)23-13-6-5-10-21(23)18-28(24)14-7-4-8-15-28/h5-6,9-13,17,19H,2-4,7-8,14-16,18H2,1H3InChIKey
HZZLYMBVVWYFSI-UHFFFAOYSA-NSynonyms
840512-16-52(3butoxyphenyl)5Hspiro(benzo(h)(124)triazolo(15c)quinazoline41cyclohexane)
840512165
CCCCOC1=CC=CC(=C1)C2=NN3C=NC4=C(C3=N2)C5(CCCCC5)CC6=CC=CC=C64
InChI=1SC28H30N4Oc1231633221291120(1722)2630272425(291932(27)3126)2313651021(23)1828(24)147481528h569131719H2478141618H21H3
MFCD04009684
ZINC000002265852
ZINC02265852
ZINC2265852
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