Vitas-M small molecule compound

2-amino-1-(2,6-difluorophenyl)-7,7-dimethyl-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

Catalog ID
STK768777
SMILES N#CC1=C(N)N(C2=C(C1c1ccsc1)C(=O)CC(C2)(C)C)c1c(F)cccc1F

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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 C22H19F2N3OS MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F2N3OS/c1-22(2)8-16-19(17(28)9-22)18(12-6-7-29-11-12)13(10-25)21(26)27(16)20-14(23)4-3-5-15(20)24/h3-7,11,18H,8-9,26H2,1-2H3
InChIKey
OUMJUDQCQAGHNQ-UHFFFAOYSA-N
Synonyms

2amino1(26difluorophenyl)77dimethyl5oxo4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2AMINO1(26DIFLUOROPHENYL)77DIMETHYL5OXO4THIOPHEN3YL68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=CC=C3F)F)N)C#N)C4=CSC=C4)C(=O)C1)C
InChI=1SC22H19F2N3OSc122(2)81619(17(28)922)18(1267291112)13(1025)21(26)27(16)2014(23)43515(20)24h371118H8926H212H3
MFCD03308244
ZINC000000720261
ZINC000000720262

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Available files

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