Vitas-M small molecule compound
ethyl 4-(5-{(1Z)-3-[(4-chlorophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoate
Catalog ID
STK984108
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(\C(=O)Nc1ccc(cc1)Cl)/C#N
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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 C23H17ClN2O4 MW 420.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN2O4/c1-2-29-23(28)16-5-3-15(4-6-16)21-12-11-20(30-21)13-17(14-25)22(27)26-19-9-7-18(24)8-10-19/h3-13H,2H2,1H3,(H,26,27)/b17-13-InChIKey
NKTYCLROIMGQGO-LGMDPLHJSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)Cl
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C(C(=O)Nc1ccc(cc1)Cl)C#N
ethyl4(5((1Z)3((4chlorophenyl)amino)2cyano3oxoprop1en1yl)furan2yl)benzoate
ETHYL4(5((Z)3(4CHLOROANILINO)2CYANO3OXOPROP1ENYL)FURAN2YL)BENZOATE
InChI=1SC23H17ClN2O4c122923(28)165315(4616)21121120(3021)1317(1425)22(27)26199718(24)81019h313H2H21H3(H2627)b1713
MFCD18181587
ZINC000035254041
ZINC35254041
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