Vitas-M small molecule compound
9-(4-chlorophenyl)-6,6-dimethyl-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK327882
SMILES Clc1ccc(cc1)C1C2=C(Nc3n1nc(n3)C(F)(F)F)CC(CC2=O)(C)C
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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 C18H16ClF3N4O MW 396.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClF3N4O/c1-17(2)7-11-13(12(27)8-17)14(9-3-5-10(19)6-4-9)26-16(23-11)24-15(25-26)18(20,21)22/h3-6,14H,7-8H2,1-2H3,(H,23,24,25)InChIKey
GNMCIIIYGHAWRJ-UHFFFAOYSA-NSynonyms
9(4chlorophenyl)66dimethyl2(trifluoromethyl)1579tetrahydro(124)triazolo(51b)quinazolin8one
9(4chlorophenyl)66dimethyl2(trifluoromethyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
CC1(CC2=C(C(N3C(=N2)N=C(N3)C(F)(F)F)C4=CC=C(C=C4)Cl)C(=O)C1)C
InChI=1SC18H16ClF3N4Oc117(2)71113(12(27)817)14(93510(19)649)2616(2311)2415(2526)18(2021)22h3614H78H212H3(H232425)
MFCD03904301
ZINC000006263410
ZINC000018202932
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