Vitas-M small molecule compound
propan-2-yl 4-{[(2E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino}benzoate
Catalog ID
STK379754
SMILES N#C/C(=C\c1ccc(cc1)Cl)/C(=O)Nc1ccc(cc1)C(=O)OC(C)C
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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 C20H17ClN2O3 MW 368.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O3/c1-13(2)26-20(25)15-5-9-18(10-6-15)23-19(24)16(12-22)11-14-3-7-17(21)8-4-14/h3-11,13H,1-2H3,(H,23,24)/b16-11+InChIKey
OALPOCUZPSKQJV-LFIBNONCSA-NSynonyms
CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N
InChI=1SC20H17ClN2O3c113(2)2620(25)155918(10615)2319(24)16(1222)11143717(21)8414h31113H12H3(H2324)b1611+
METHYLETHYL4((2E)3(4CHLOROPHENYL)2CYANOPROP2ENOYLAMINO)BENZOATE
MFCD02105133
N#CC(=Cc1ccc(cc1)Cl)C(=O)Nc1ccc(cc1)C(=O)OC(C)C
propan2yl4(((2E)3(4chlorophenyl)2cyanoprop2enoyl)amino)benzoate
propan2yl4(((E)3(4chlorophenyl)2cyanoprop2enoyl)amino)benzoate
ZINC000000946434
ZINC00946434
ZINC946434
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