Vitas-M small molecule compound
4-(3-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK770526
SMILES COc1cccc(c1)n1c(=O)c2c(n3c1nnc3)c1ccccc1CC12CCCCC1
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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/c1-31-19-10-7-9-18(14-19)29-23(30)21-22(28-16-26-27-24(28)29)20-11-4-3-8-17(20)15-25(21)12-5-2-6-13-25/h3-4,7-11,14,16H,2,5-6,12-13,15H2,1H3InChIKey
ZMOQHOROHUHNDA-UHFFFAOYSA-NSynonyms
4(3methoxyphenyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NN=C6
InChI=1SC25H24N4O2c13119107918(1419)2923(30)2122(2816262724(28)29)201143817(20)1525(21)125261325h347111416H256121315H21H3
MFCD02238494
ZINC000002479359
ZINC2479359
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