Vitas-M small molecule compound
methyl 2-{[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]amino}-4-chlorobenzoate
Catalog ID
STK715964
SMILES N#C/C(=C\Nc1cc(Cl)ccc1C(=O)OC)/C(=O)NCc1ccccc1
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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 C19H16ClN3O3 MW 369.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3/c1-26-19(25)16-8-7-15(20)9-17(16)22-12-14(10-21)18(24)23-11-13-5-3-2-4-6-13/h2-9,12,22H,11H2,1H3,(H,23,24)/b14-12+InChIKey
SZAKCDYUFREHCW-WYMLVPIESA-NSynonyms
COC(=O)C1=C(C=C(C=C1)Cl)NC=C(C#N)C(=O)NCC2=CC=CC=C2
InChI=1SC19H16ClN3O3c12619(25)168715(20)917(16)221214(1021)18(24)2311135324613h291222H11H21H3(H2324)b1412+
methyl2(((1E)3(benzylamino)2cyano3oxoprop1en1yl)amino)4chlorobenzoate
methyl2(((E)3(benzylamino)2cyano3oxoprop1enyl)amino)4chlorobenzoate
methyl2((3(benzylamino)2cyano3oxoprop1en1yl)amino)4chlorobenzoate
MFCD08292194
N#CC(=CNc1cc(Cl)ccc1C(=O)OC)C(=O)NCc1ccccc1
ZINC000006760553
ZINC06760553
ZINC6760553
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