Vitas-M small molecule compound
2-[2-amino-4-(2-chloro-6-fluorophenyl)-3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Catalog ID
STK688788
SMILES N#CC1=C(N)N(C2=C(C1c1c(F)cccc1Cl)C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1
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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 C26H21ClFN5OS MW 506.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClFN5OS/c27-16-3-1-4-17(28)22(16)21-14(11-29)24(31)33(18-5-2-6-19(34)23(18)21)25-15(12-30)20-13-7-9-32(10-8-13)26(20)35-25/h1,3-4,13,21H,2,5-10,31H2InChIKey
AWDPRPCUVMGJBZ-UHFFFAOYSA-NSynonyms
2(2amino4(2chloro6fluorophenyl)3cyano5oxo5678tetrahydroquinolin1(4H)yl)56dihydro4H47ethanothieno(23b)pyridine3carbonitrile
C1CC2=C(C(C(=C(N2C3=C(C4=C(S3)N5CCC4CC5)C#N)N)C#N)C6=C(C=CC=C6Cl)F)C(=O)C1
InChI=1SC26H21ClFN5OSc271631417(28)22(16)2114(1129)24(31)33(1852619(34)23(18)21)2515(1230)20137932(10813)26(20)3525h1341321H251031H2
MFCD07658630
ZINC000012428373
ZINC000012428374
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