Vitas-M small molecule compound
ethyl (2Z)-3-[(2-bromophenyl)amino]-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-3-oxopropanoate
Catalog ID
STL322345
SMILES CCOC(=O)/C(=C/1\NC(C)(C)Cc2c1cccc2)/C(=O)Nc1ccccc1Br
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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)24-17-12-8-7-11-16(17)23)19-15-10-6-5-9-14(15)13-22(2,3)25-19/h5-12,25H,4,13H2,1-3H3,(H,24,26)/b19-18-InChIKey
JSEYSNAVBBUPMD-HNENSFHCSA-NSynonyms
305864-16-8(Z)ethyl3((2bromophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
305864168
CCOC(=O)C(=C1C2=CC=CC=C2CC(N1)(C)C)C(=O)NC3=CC=CC=C3Br
CCOC(=O)C(=C1NC(C)(C)Cc2c1cccc2)C(=O)Nc1ccccc1Br
ethyl(2Z)3((2bromophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
ETHYL(2Z)3(2BROMOANILINO)2(33DIMETHYL24DIHYDROISOQUINOLIN1YLIDENE)3OXOPROPANOATE
InChI=1SC22H23BrN2O3c142821(27)18(20(26)241712871116(17)23)19151065914(15)1322(23)2519h51225H413H213H3(H2426)b1918
MFCD01088825
ZINC000008691407
ZINC8691407
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