Vitas-M small molecule compound
9-(3-bromophenyl)-6-(3,4-dimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK335221
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1n(C2c2cccc(c2)Br)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 C23H21BrN4O3 MW 481.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN4O3/c1-30-19-7-6-13(11-20(19)31-2)15-9-17-21(18(29)10-15)22(14-4-3-5-16(24)8-14)28-23(27-17)25-12-26-28/h3-8,11-12,15,22H,9-10H2,1-2H3,(H,25,26,27)InChIKey
BAAWQOXGMYXPKT-UHFFFAOYSA-NSynonyms
9(3bromophenyl)6(34dimethoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3bromophenyl)6(34dimethoxyphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
COC1=C(C=C(C=C1)C2CC3=C(C(N4C(=N3)N=CN4)C5=CC(=CC=C5)Br)C(=O)C2)OC
InChI=1SC23H21BrN4O3c130197613(1120(19)312)1591721(18(29)1015)22(1443516(24)814)2823(2717)25122628h3811121522H910H212H3(H252627)
MFCD09963855
ZINC000018198447
ZINC000018198453
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