Vitas-M small molecule compound
7'-amino-2'-[(4-fluorobenzyl)sulfanyl]-1-methyl-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Catalog ID
STK781435
SMILES N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)C)c(=O)[nH]c(n2)SCc1ccc(cc1)F
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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 C23H17FN6O2S MW 460.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FN6O2S/c1-30-16-5-3-2-4-14(16)23(21(30)32)15(10-25)18(26)27-19-17(23)20(31)29-22(28-19)33-11-12-6-8-13(24)9-7-12/h2-9H,11,26H2,1H3,(H2,27,28,29,31)InChIKey
OAEMJBUQPUEWCI-UHFFFAOYSA-NSynonyms
7amino2((4fluorobenzyl)sulfanyl)1methyl24dioxo1248tetrahydro3Hspiro(indole35pyrido(23d)pyrimidine)6carbonitrile
7AMINO2((4FLUOROPHENYL)METHYLSULFANYL)1METHYL24DIOXOSPIRO(18DIHYDROPYRIDO(23D)PYRIMIDINE53INDOLE)6CARBONITRILE
CN1C2=CC=CC=C2C3(C1=O)C(=C(NC4=C3C(=O)N=C(N4)SCC5=CC=C(C=C5)F)N)C#N
InChI=1SC23H17FN6O2Sc13016532414(16)23(21(30)32)15(1025)18(26)271917(23)20(31)2922(2819)3311126813(24)9712h29H1126H21H3(H227282931)
MFCD06015048
N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)C)c(=O)(nH)c(n2)SCc1ccc(cc1)F
ZINC000012416890
ZINC000012416892
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