Vitas-M small molecule compound
9-(3,5-difluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK232158
SMILES Fc1cc(cc(c1)F)C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccc(cc1)[N+](=O)[O-]
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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 C22H17F2N5O3S MW 469.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F2N5O3S/c23-14-8-13(9-15(24)10-14)20-19-17(2-1-3-18(19)30)25-21-26-22(27-28(20)21)33-11-12-4-6-16(7-5-12)29(31)32/h4-10,20H,1-3,11H2,(H,25,26,27)InChIKey
OADCIJJGVFOCCH-UHFFFAOYSA-NSynonyms
777871-13-3777871133
9(35difluorophenyl)2((4nitrobenzyl)sulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(35difluorophenyl)2((4nitrobenzyl)thio)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(35difluorophenyl)2((4nitrophenyl)methylsulfanyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
C1CC2=C(C(N3C(=N2)N=C(N3)SCC4=CC=C(C=C4)(N+)(=O)(O))C5=CC(=CC(=C5)F)F)C(=O)C1
Fc1cc(cc(c1)F)C1C2=C(CCCC2=O)Nc2n1nc(n2)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H17F2N5O3Sc2314813(915(24)1014)201917(21318(19)30)25212622(2728(20)21)3311124616(7512)29(31)32h41020H1311H2(H252627)
MFCD06605009
ZINC000009232924
ZINC000009427121
Check stock
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