Vitas-M small molecule compound
methyl 2-({(1Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}amino)-4,5-dimethoxybenzoate
Catalog ID
STK829079
SMILES N#C/C(=C/Nc1cc(OC)c(cc1C(=O)OC)OC)/C(=O)Nc1ccc(cc1)F
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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 C20H18FN3O5 MW 399.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FN3O5/c1-27-17-8-15(20(26)29-3)16(9-18(17)28-2)23-11-12(10-22)19(25)24-14-6-4-13(21)5-7-14/h4-9,11,23H,1-3H3,(H,24,25)/b12-11-InChIKey
UJMZEULUTOGLEA-QXMHVHEDSA-NSynonyms
885183-83-5(E)methyl2((2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)amino)45dimethoxybenzoate
885183835
COC1=C(C=C(C(=C1)C(=O)OC)NC=C(C#N)C(=O)NC2=CC=C(C=C2)F)OC
InChI=1SC20H18FN3O5c12717815(20(26)293)16(918(17)282)231112(1022)19(25)24146413(21)5714h491123H13H3(H2425)b1211
methyl2(((1Z)2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)amino)45dimethoxybenzoate
METHYL2(((Z)2CYANO3(4FLUOROANILINO)3OXOPROP1ENYL)AMINO)45DIMETHOXYBENZOATE
MFCD08166870
N#CC(=CNc1cc(OC)c(cc1C(=O)OC)OC)C(=O)Nc1ccc(cc1)F
ZINC000101192740
ZINC101192740
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