Vitas-M small molecule compound
4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK833344
SMILES COc1ccc(cc1)n1c2nncn2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C25H24N4O2 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2/c1-31-19-11-9-18(10-12-19)29-23(30)21-22(28-16-26-27-24(28)29)20-8-4-3-7-17(20)15-25(21)13-5-2-6-14-25/h3-4,7-12,16H,2,5-6,13-15H2,1H3InChIKey
QAYHSGBEMAFIEL-UHFFFAOYSA-NSynonyms
372506-00-8372506008
4(4methoxyphenyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NN=C6
InChI=1SC25H24N4O2c1311911918(101219)2923(30)2122(2816262724(28)29)20843717(20)1525(21)135261425h3471216H2561315H21H3
MFCD01945010
ZINC000000986055
ZINC986055
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