Vitas-M small molecule compound
methyl 2-{[(2E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-cyanoprop-2-enoyl]amino}benzoate
Catalog ID
STK522839
SMILES N#C/C(=C\c1cc(Cl)c(c(c1)OC)OC)/C(=O)Nc1ccccc1C(=O)OC
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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 C20H17ClN2O5 MW 400.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O5/c1-26-17-10-12(9-15(21)18(17)27-2)8-13(11-22)19(24)23-16-7-5-4-6-14(16)20(25)28-3/h4-10H,1-3H3,(H,23,24)/b13-8+InChIKey
GNEGOVJYDYDNFM-MDWZMJQESA-NSynonyms
380476-38-0380476380
COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)OC)Cl)OC
InChI=1SC20H17ClN2O5c126171012(915(21)18(17)272)813(1122)19(24)2316754614(16)20(25)283h410H13H3(H2324)b138+
methyl2(((2E)3(3chloro45dimethoxyphenyl)2cyanoprop2enoyl)amino)benzoate
METHYL2(((E)3(3CHLORO45DIMETHOXYPHENYL)2CYANOPROP2ENOYL)AMINO)BENZOATE
MFCD03155104
N#CC(=Cc1cc(Cl)c(c(c1)OC)OC)C(=O)Nc1ccccc1C(=O)OC
ZINC000001439571
ZINC01439571
ZINC1439571
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