Vitas-M small molecule compound
ethyl (3-{(1E)-3-[(3-bromophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-1H-indol-1-yl)acetate
Catalog ID
STK183133
SMILES CCOC(=O)Cn1cc(c2c1cccc2)/C=C(/C(=O)Nc1cccc(c1)Br)\C#N
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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 C22H18BrN3O3 MW 452.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O3/c1-2-29-21(27)14-26-13-16(19-8-3-4-9-20(19)26)10-15(12-24)22(28)25-18-7-5-6-17(23)11-18/h3-11,13H,2,14H2,1H3,(H,25,28)/b15-10+InChIKey
CMWYXIFBHGSYDZ-XNTDXEJSSA-NSynonyms
(E)ethyl2(3(3((3bromophenyl)amino)2cyano3oxoprop1en1yl)1Hindol1yl)acetate
CCOC(=O)CN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=CC(=CC=C3)Br
CCOC(=O)Cn1cc(c2c1cccc2)C=C(C(=O)Nc1cccc(c1)Br)C#N
ETHYL(3((1E)3((3BROMOPHENYL)AMINO)2CYANO3OXOPROP1EN1YL)1HINDOL1YL)ACETATE
ETHYL2(3((E)3(3BROMOANILINO)2CYANO3OXOPROP1ENYL)INDOL1YL)ACETATE
InChI=1SC22H18BrN3O3c122921(27)14261316(19834920(19)26)1015(1224)22(28)251875617(23)1118h31113H214H21H3(H2528)b1510+
MFCD02628848
ZINC000002305611
ZINC02305611
ZINC2305611
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