Vitas-M small molecule compound

ethyl (2E)-3-[(2,4-dichlorophenyl)amino]-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-3-oxopropanoate

Catalog ID
STK805520
SMILES CCOC(=O)/C(=C\1/NC(C)(C)Cc2c1cccc2)/C(=O)Nc1ccc(cc1Cl)Cl

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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 C22H22Cl2N2O3 MW 433.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O3/c1-4-29-21(28)18(20(27)25-17-10-9-14(23)11-16(17)24)19-15-8-6-5-7-13(15)12-22(2,3)26-19/h5-11,26H,4,12H2,1-3H3,(H,25,27)/b19-18+
InChIKey
QUCLDYXMUZHWNE-VHEBQXMUSA-N
Synonyms
1164481-93-9
(E)ethyl3((24dichlorophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
1164481939
CCOC(=O)C(=C1C2=CC=CC=C2CC(N1)(C)C)C(=O)NC3=C(C=C(C=C3)Cl)Cl
CCOC(=O)C(=C1NC(C)(C)Cc2c1cccc2)C(=O)Nc1ccc(cc1Cl)Cl
ethyl(2E)3((24dichlorophenyl)amino)2(33dimethyl34dihydroisoquinolin1(2H)ylidene)3oxopropanoate
ethyl(2E)3(24dichloroanilino)2(33dimethyl24dihydroisoquinolin1ylidene)3oxopropanoate
ETHYL2(N(24DICHLOROPHENYL)CARBAMOYL)2(33DIMETHYL(234TRIHYDROISOQUINOLYLIDENE))ACETATE
InChI=1SC22H22Cl2N2O3c142921(28)18(20(27)251710914(23)1116(17)24)1915865713(15)1222(23)2619h51126H412H213H3(H2527)b1918+
ZINC000008687082
ZINC08687082
ZINC8687082

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Available files

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