Vitas-M small molecule compound
ethyl (2E)-3-[(4-bromophenyl)amino]-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-3-oxopropanoate
Catalog ID
STK833979
SMILES CCOC(=O)/C(=C\1/NC(C)(C)Cc2c1cccc2)/C(=O)Nc1ccc(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 C22H23BrN2O3 MW 443.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O3/c1-4-28-21(27)18(20(26)24-16-11-9-15(23)10-12-16)19-17-8-6-5-7-14(17)13-22(2,3)25-19/h5-12,25H,4,13H2,1-3H3,(H,24,26)/b19-18+InChIKey
BIRJBIYALJEWSG-VHEBQXMUSA-NSynonyms
1164479-22-4(E)ethyl3((4bromophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
1164479224
CCOC(=O)C(=C1C2=CC=CC=C2CC(N1)(C)C)C(=O)NC3=CC=C(C=C3)Br
CCOC(=O)C(=C1NC(C)(C)Cc2c1cccc2)C(=O)Nc1ccc(cc1)Br
ethyl(2E)3((4bromophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
ETHYL(2E)3(4BROMOANILINO)2(33DIMETHYL24DIHYDROISOQUINOLIN1YLIDENE)3OXOPROPANOATE
InChI=1SC22H23BrN2O3c142821(27)18(20(26)241611915(23)101216)1917865714(17)1322(23)2519h51225H413H213H3(H2426)b1918+
N(4BROMOPHENYL)2(33DIMETHYL34DIHYDRO2HISOQUINOLIN(1E)YLIDENE)MALONAMICACIDETHYLESTER
ZINC000008691590
ZINC08691590
ZINC8691590
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