Vitas-M small molecule compound
2-[3-(pentyloxy)phenyl]-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Catalog ID
STK928991
SMILES CCCCCOc1cccc(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 C29H32N4O MW 452.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O/c1-2-3-9-17-34-23-13-10-12-21(18-23)27-31-28-25-26(30-20-33(28)32-27)24-14-6-5-11-22(24)19-29(25)15-7-4-8-16-29/h5-6,10-14,18,20H,2-4,7-9,15-17,19H2,1H3InChIKey
UZHDMDFUSIQDHR-UHFFFAOYSA-NSynonyms
847272-45-12(3(pentyloxy)phenyl)5Hspiro(benzo(h)(124)triazolo(15c)quinazoline41cyclohexane)
847272451
CCCCCOC1=CC=CC(=C1)C2=NN3C=NC4=C(C3=N2)C5(CCCCC5)CC6=CC=CC=C64
InChI=1SC29H32N4Oc123917342313101221(1823)2731282526(302033(28)3227)2414651122(24)1929(25)157481629h5610141820H2479151719H21H3
MFCD04179441
ZINC000002198937
ZINC02198937
ZINC2198937
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