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-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Catalog ID
STK758648
SMILES N#CC1=C(N)N(C2=C(C1c1cscc1)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 C25H24N4OS2 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4OS2/c1-25(2)9-18-22(19(30)10-25)21(14-7-8-31-13-14)17(12-27)23(28)29(18)24-16(11-26)15-5-3-4-6-20(15)32-24/h7-8,13,21H,3-6,9-10,28H2,1-2H3
InChIKey
WSWMGFYTLDHSBU-UHFFFAOYSA-N
Synonyms

2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl5oxo4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2amino1(3cyano4567tetrahydro1benzothiophen2yl)77dimethyl5oxo4thiophen3yl68dihydro4Hquinoline3carbonitrile
CC1(CC2=C(C(C(=C(N2C3=C(C4=C(S3)CCCC4)C#N)N)C#N)C5=CSC=C5)C(=O)C1)C
InChI=1SC25H24N4OS2c125(2)91822(19(30)1025)21(1478311314)17(1227)23(28)29(18)2416(1126)15534620(15)3224h781321H3691028H212H3
MFCD01460098
ZINC000002380195
ZINC000003666910

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Available files

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