Vitas-M small molecule compound
2-[2-amino-4-(3-chlorophenyl)-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
STK687449
SMILES N#CC1=C(N)N(C2=C(C1c1cccc(c1)Cl)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 C26H22ClN5OS MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5OS/c27-16-4-1-3-15(11-16)21-17(12-28)24(30)32(19-5-2-6-20(33)23(19)21)25-18(13-29)22-14-7-9-31(10-8-14)26(22)34-25/h1,3-4,11,14,21H,2,5-10,30H2InChIKey
ZNGFDLSFINHCJA-UHFFFAOYSA-NSynonyms
2(2amino4(3chlorophenyl)3cyano5oxo5678tetrahydroquinolin1(4H)yl)56dihydro4H47ethanothieno(23b)pyridine3carbonitrile
C1CC2=C(C(C(=C(N2C3=C(C4=C(S3)N5CCC4CC5)C#N)N)C#N)C6=CC(=CC=C6)Cl)C(=O)C1
InChI=1SC26H22ClN5OSc271641315(1116)2117(1228)24(30)32(1952620(33)23(19)21)2518(1329)22147931(10814)26(22)3425h134111421H251030H2
MFCD06618875
ZINC000012428704
ZINC000012428705
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