Vitas-M small molecule compound
9-[4-(benzyloxy)-3-methoxyphenyl]-6-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335058
SMILES COc1cc(ccc1OCc1ccccc1)C1C2=C(CC(CC2=O)c2cc(OC)c(c(c2)OC)OC)Nc2n1ncn2
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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 C32H32N4O6 MW 568.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O6/c1-38-26-14-20(10-11-25(26)42-17-19-8-6-5-7-9-19)30-29-23(35-32-33-18-34-36(30)32)12-21(13-24(29)37)22-15-27(39-2)31(41-4)28(16-22)40-3/h5-11,14-16,18,21,30H,12-13,17H2,1-4H3,(H,33,34,35)InChIKey
OGCDCQAKQZHZTK-UHFFFAOYSA-NSynonyms
9(3methoxy4phenylmethoxyphenyl)6(345trimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
9(4(benzyloxy)3methoxyphenyl)6(345trimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(N4C(=N3)N=CN4)C5=CC(=C(C=C5)OCC6=CC=CC=C6)OC)C(=O)C2
InChI=1SC32H32N4O6c138261420(101125(26)4217198657919)302923(353233183436(30)32)1221(1324(29)37)221527(392)31(414)28(1622)403h5111416182130H121317H214H3(H333435)
MFCD09963834
ZINC000102051916
ZINC000102051927
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