Vitas-M small molecule compound
2'-amino-5-fluoro-7',7'-dimethyl-2,5'-dioxo-1'-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK778406
SMILES N#CC1=C(N)N(c2nnc(s2)SC(C)C)C2=C(C31C(=O)Nc1c3cc(F)cc1)C(=O)CC(C2)(C)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 C24H23FN6O2S2 MW 510.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23FN6O2S2/c1-11(2)34-22-30-29-21(35-22)31-16-8-23(3,4)9-17(32)18(16)24(14(10-26)19(31)27)13-7-12(25)5-6-15(13)28-20(24)33/h5-7,11H,8-9,27H2,1-4H3,(H,28,33)InChIKey
BPVLAXWKHQYQIG-UHFFFAOYSA-NSynonyms
2amino5fluoro77dimethyl25dioxo1(5(propan2ylsulfanyl)134thiadiazol2yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
2amino5fluoro77dimethyl25dioxo1(5propan2ylsulfanyl134thiadiazol2yl)spiro(1Hindole3468dihydroquinoline)3carbonitrile
CC(C)SC1=NN=C(S1)N2C3=C(C(=O)CC(C3)(C)C)C4(C5=C(C=CC(=C5)F)NC4=O)C(=C2N)C#N
InChI=1SC24H23FN6O2S2c111(2)3422302921(3522)3116823(34)917(32)18(16)24(14(1026)19(31)27)13712(25)5615(13)2820(24)33h5711H8927H214H3(H2833)
MFCD05856540
ZINC000012401667
ZINC000012401668
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