Vitas-M small molecule compound
methyl 2-(5-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoate
Catalog ID
STK949998
SMILES N#C/C(=C\c1ccc(o1)c1ccccc1C(=O)OC)/C(=O)NCc1ccco1
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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 C21H16N2O5 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O5/c1-26-21(25)18-7-3-2-6-17(18)19-9-8-15(28-19)11-14(12-22)20(24)23-13-16-5-4-10-27-16/h2-11H,13H2,1H3,(H,23,24)/b14-11+InChIKey
SLSIFYVLHUWLEZ-SDNWHVSQSA-NSynonyms
847178-41-0(E)methyl2(5(2cyano3((furan2ylmethyl)amino)3oxoprop1en1yl)furan2yl)benzoate
847178410
COC(=O)C1=CC=CC=C1C2=CC=C(O2)C=C(C#N)C(=O)NCC3=CC=CO3
InChI=1SC21H16N2O5c12621(25)18732617(18)199815(2819)1114(1222)20(24)23131654102716h211H13H21H3(H2324)b1411+
METHYL2(5((1E)2CYANO2(N(2FURYLMETHYL)CARBAMOYL)VINYL)2FURYL)BENZOATE
methyl2(5((1E)2cyano3((furan2ylmethyl)amino)3oxoprop1en1yl)furan2yl)benzoate
METHYL2(5((E)2CYANO3(FURAN2YLMETHYLAMINO)3OXOPROP1ENYL)FURAN2YL)BENZOATE
MFCD04183950
N#CC(=Cc1ccc(o1)c1ccccc1C(=O)OC)C(=O)NCc1ccco1
ZINC000002393315
ZINC02393315
ZINC2393315
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