Vitas-M small molecule compound

ethyl 2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK758170
SMILES CCOC(=O)C1=C(N)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1ccc(cc1)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 C24H25BrN2O3S MW 501.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25BrN2O3S/c1-4-30-23(29)21-20(18-6-5-11-31-18)19-16(12-24(2,3)13-17(19)28)27(22(21)26)15-9-7-14(25)8-10-15/h5-11,20H,4,12-13,26H2,1-3H3
InChIKey
LDBZZANVYFOJNJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C(C1C3=CC=CS3)C(=O)CC(C2)(C)C)C4=CC=C(C=C4)Br)N
ethyl2amino1(4bromophenyl)77dimethyl5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
ETHYL2AMINO1(4BROMOPHENYL)77DIMETHYL5OXO4THIOPHEN2YL68DIHYDRO4HQUINOLINE3CARBOXYLATE
InChI=1SC24H25BrN2O3Sc143023(29)2120(1865113118)1916(1224(23)1317(19)28)27(22(21)26)159714(25)81015h51120H4121326H213H3
MFCD01414392
ZINC000001022908
ZINC000001022909

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Available files

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