Vitas-M small molecule compound
2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-7,7-dimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK757795
SMILES N#CC1=C(N)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1sc2c(c1C#N)CCCC2
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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 C26H25N5OS MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5OS/c1-26(2)10-19-23(20(32)11-26)22(15-6-5-9-30-14-15)18(13-28)24(29)31(19)25-17(12-27)16-7-3-4-8-21(16)33-25/h5-6,9,14,22H,3-4,7-8,10-11,29H2,1-2H3InChIKey
FUZHYJHPPCAXMF-UHFFFAOYSA-NSynonyms
2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl5oxo4(pyridin3yl)145678hexahydroquinoline3carbonitrile
2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl5oxo4pyridin3yl68dihydro4Hquinoline3carbonitrile
CC1(CC2=C(C(C(=C(N2C3=C(C4=C(S3)CCCC4)C#N)N)C#N)C5=CN=CC=C5)C(=O)C1)C
InChI=1SC26H25N5OSc126(2)101923(20(32)1126)22(15659301415)18(1328)24(29)31(19)2517(1227)16734821(16)3325h5691422H3478101129H212H3
MFCD01305010
ZINC000000714755
ZINC000000714756
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