Vitas-M small molecule compound
2-amino-1-(4-bromo-2-fluorophenyl)-7,7-dimethyl-5-oxo-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK761059
SMILES N#CC1=C(N)N(C2=C(C1c1cscc1)C(=O)CC(C2)(C)C)c1ccc(cc1F)Br
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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 C22H19BrFN3OS MW 472.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrFN3OS/c1-22(2)8-17-20(18(28)9-22)19(12-5-6-29-11-12)14(10-25)21(26)27(17)16-4-3-13(23)7-15(16)24/h3-7,11,19H,8-9,26H2,1-2H3InChIKey
NRKWHTNHHDACJY-UHFFFAOYSA-NSynonyms
309281-17-22amino1(4bromo2fluorophenyl)77dimethyl5oxo4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2AMINO1(4BROMO2FLUOROPHENYL)77DIMETHYL5OXO4THIOPHEN3YL68DIHYDRO4HQUINOLINE3CARBONITRILE
309281172
CC1(CC2=C(C(C(=C(N2C3=C(C=C(C=C3)Br)F)N)C#N)C4=CSC=C4)C(=O)C1)C
InChI=1SC22H19BrFN3OSc122(2)81720(18(28)922)19(1256291112)14(1025)21(26)27(17)164313(23)715(16)24h371119H8926H212H3
MFCD01820479
ZINC000001064832
ZINC000001064834
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