Vitas-M small molecule compound
3-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Catalog ID
STL351924
SMILES O=C1Nc2ccccc2CCC1Sc1nnc(n1c1ccccc1)c1ccncc1
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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 C23H19N5OS MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5OS/c29-22-20(11-10-16-6-4-5-9-19(16)25-22)30-23-27-26-21(17-12-14-24-15-13-17)28(23)18-7-2-1-3-8-18/h1-9,12-15,20H,10-11H2,(H,25,29)InChIKey
CMGURJPTLCEWSO-UHFFFAOYSA-NSynonyms
1040710-81-31040710813
3((4phenyl5(pyridin4yl)4H124triazol3yl)sulfanyl)1345tetrahydro2H1benzazepin2one
3((4phenyl5(pyridin4yl)4H124triazol3yl)thio)45dihydro1Hbenzo(b)azepin2(3H)one
3((4phenyl5pyridin4yl124triazol3yl)sulfanyl)1345tetrahydro1benzazepin2one
C1CC2=CC=CC=C2NC(=O)C1SC3=NN=C(N3C4=CC=CC=C4)C5=CC=NC=C5
InChI=1SC23H19N5OSc292220(111016645919(16)2522)3023272621(17121424151317)28(23)187213818h19121520H1011H2(H2529)
MFCD12209766
ZINC000020744596
ZINC000020744597
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