Vitas-M small molecule compound
2'-amino-5-fluoro-1'-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK778588
SMILES N#CC1=C(N)N(c2nnc(s2)SC)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 C20H15FN6O2S2 MW 454.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN6O2S2/c1-30-19-26-25-18(31-19)27-13-3-2-4-14(28)15(13)20(11(8-22)16(27)23)10-7-9(21)5-6-12(10)24-17(20)29/h5-7H,2-4,23H2,1H3,(H,24,29)InChIKey
KWHLXUOOVOTJSA-UHFFFAOYSA-NSynonyms
2amino5fluoro1(5(methylsulfanyl)134thiadiazol2yl)25dioxo125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino5fluoro1(5methylsulfanyl134thiadiazol2yl)25dioxospiro(1Hindole3478dihydro6Hquinoline)3carbonitrile
CSC1=NN=C(S1)N2C3=C(C(=O)CCC3)C4(C5=C(C=CC(=C5)F)NC4=O)C(=C2N)C#N
InChI=1SC20H15FN6O2S2c13019262518(3119)271332414(28)15(13)20(11(822)16(27)23)1079(21)5612(10)2417(20)29h57H2423H21H3(H2429)
MFCD05856842
ZINC000012371922
ZINC000012371923
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