Vitas-M small molecule compound
2-amino-9-(3,4-dichlorophenyl)-6-(3,4-dimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335439
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1n(C2c2ccc(c(c2)Cl)Cl)nc(n1)N
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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 C23H21Cl2N5O3 MW 486.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21Cl2N5O3/c1-32-18-6-4-11(10-19(18)33-2)13-8-16-20(17(31)9-13)21(12-3-5-14(24)15(25)7-12)30-23(27-16)28-22(26)29-30/h3-7,10,13,21H,8-9H2,1-2H3,(H3,26,27,28,29)InChIKey
JNOFOZIGBXTKBE-UHFFFAOYSA-NSynonyms
2amino9(34dichlorophenyl)6(34dimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
2amino9(34dichlorophenyl)6(34dimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
COC1=C(C=C(C=C1)C2CC3=C(C(N4C(=N3)N=C(N4)N)C5=CC(=C(C=C5)Cl)Cl)C(=O)C2)OC
InChI=1SC23H21Cl2N5O3c132186411(1019(18)332)1381620(17(31)913)21(123514(24)15(25)712)3023(2716)2822(26)2930h37101321H89H212H3(H326272829)
MFCD09963999
ZINC000018199038
ZINC000018199043
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