Vitas-M small molecule compound
methyl 4-{[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]amino}benzoate
Catalog ID
STL027509
SMILES N#C/C(=C\Nc1ccc(cc1)C(=O)OC)/C(=O)Nc1ccccc1
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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 C18H15N3O3 MW 321.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O3/c1-24-18(23)13-7-9-15(10-8-13)20-12-14(11-19)17(22)21-16-5-3-2-4-6-16/h2-10,12,20H,1H3,(H,21,22)/b14-12+InChIKey
OHTIDXVDCBQQRX-WYMLVPIESA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC=C(C#N)C(=O)NC2=CC=CC=C2
InChI=1SC18H15N3O3c12418(23)137915(10813)201214(1119)17(22)21165324616h2101220H1H3(H2122)b1412+
methyl4(((1E)2cyano3oxo3(phenylamino)prop1en1yl)amino)benzoate
methyl4(((E)3anilino2cyano3oxoprop1enyl)amino)benzoate
MFCD18188149
N#CC(=CNc1ccc(cc1)C(=O)OC)C(=O)Nc1ccccc1
ZINC000057413980
ZINC57413980
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