Vitas-M small molecule compound
{2-[8-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl]phenoxy}acetic acid
Catalog ID
STK335018
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1n(C2c2ccccc2OCC(=O)O)ncn1
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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 C26H26N4O7 MW 506.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O7/c1-34-20-10-15(11-21(35-2)25(20)36-3)14-8-17-23(18(31)9-14)24(30-26(29-17)27-13-28-30)16-6-4-5-7-19(16)37-12-22(32)33/h4-7,10-11,13-14,24H,8-9,12H2,1-3H3,(H,32,33)(H,27,28,29)InChIKey
PLDXWSURYCYFNE-UHFFFAOYSA-NSynonyms
(2(8oxo6(345trimethoxyphenyl)456789hexahydro(124)triazolo(51b)quinazolin9yl)phenoxy)aceticacid
2(2(8oxo6(345trimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin9yl)phenoxy)aceticacid
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(N4C(=N3)N=CN4)C5=CC=CC=C5OCC(=O)O)C(=O)C2
InChI=1SC26H26N4O7c134201015(1121(352)25(20)363)1481723(18(31)914)24(3026(2917)27132830)16645719(16)371222(32)33h471011131424H8912H213H3(H3233)(H272829)
MFCD09963804
ZINC000018198102
ZINC000018198108
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