Vitas-M small molecule compound
9-(3,5-difluorophenyl)-2-methyl-6-(thiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK250492
SMILES Fc1cc(F)cc(c1)C1C2=C(CC(CC2=O)c2cccs2)Nc2n1nc(n2)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 C20H16F2N4OS MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F2N4OS/c1-10-23-20-24-15-7-11(17-3-2-4-28-17)8-16(27)18(15)19(26(20)25-10)12-5-13(21)9-14(22)6-12/h2-6,9,11,19H,7-8H2,1H3,(H,23,24,25)InChIKey
KERRXZUYACANCR-UHFFFAOYSA-NSynonyms
777870-71-0777870710
9(35difluorophenyl)2methyl6(thiophen2yl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(35difluorophenyl)2methyl6thiophen2yl5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CC1=NC2=NC3=C(C(N2N1)C4=CC(=CC(=C4)F)F)C(=O)CC(C3)C5=CC=CS5
InChI=1SC20H16F2N4OSc11023202415711(173242817)816(27)18(15)19(26(20)2510)12513(21)914(22)612h2691119H78H21H3(H232425)
MFCD06611893
ZINC000004488259
ZINC000004488262
ZINC04488259
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