Vitas-M small molecule compound

2'-amino-1'-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-fluoro-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile

Catalog ID
STK684901
SMILES N#CC1=C(N)N(c2nnc(s2)SCc2ccccc2)C2=C(C31C(=O)Nc1c3cc(F)cc1)C(=O)CCC2

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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 C26H19FN6O2S2 MW 530.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN6O2S2/c27-15-9-10-18-16(11-15)26(23(35)30-18)17(12-28)22(29)33(19-7-4-8-20(34)21(19)26)24-31-32-25(37-24)36-13-14-5-2-1-3-6-14/h1-3,5-6,9-11H,4,7-8,13,29H2,(H,30,35)
InChIKey
ILLZSJSCXGLKBG-UHFFFAOYSA-N
Synonyms
2amino1(5(benzylsulfanyl)134thiadiazol2yl)5fluoro25dioxo125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino1(5benzylsulfanyl134thiadiazol2yl)5fluoro25dioxospiro(1Hindole3478dihydro6Hquinoline)3carbonitrile
C1CC2=C(C(=O)C1)C3(C4=C(C=CC(=C4)F)NC3=O)C(=C(N2C5=NN=C(S5)SCC6=CC=CC=C6)N)C#N
Registry IDs
MFCD05856523
ZINC000098007185
ZINC000098007186

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Available files

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