Vitas-M small molecule compound
2-cyanobenzyl 2-chloro-5-{5-[(1E)-2-cyano-3-(methylamino)-3-oxoprop-1-en-1-yl]furan-2-yl}benzoate
Catalog ID
STK287215
SMILES N#C/C(=C\c1ccc(o1)c1ccc(c(c1)C(=O)OCc1ccccc1C#N)Cl)/C(=O)NC
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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 C24H16ClN3O4 MW 445.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16ClN3O4/c1-28-23(29)18(13-27)10-19-7-9-22(32-19)15-6-8-21(25)20(11-15)24(30)31-14-17-5-3-2-4-16(17)12-26/h2-11H,14H2,1H3,(H,28,29)/b18-10+InChIKey
ZIKBZUCPIWFBRL-VCHYOVAHSA-NSynonyms
(2CYANOPHENYL)METHYL2CHLORO5(5((E)2CYANO3(METHYLAMINO)3OXOPROP1ENYL)FURAN2YL)BENZOATE
2CYANOBENZYL2CHLORO5(5((1E)2CYANO3(METHYLAMINO)3OXOPROP1EN1YL)FURAN2YL)BENZOATE
CNC(=O)C(=CC1=CC=C(O1)C2=CC(=C(C=C2)Cl)C(=O)OCC3=CC=CC=C3C#N)C#N
InChI=1SC24H16ClN3O4c12823(29)18(1327)10197922(3219)156821(25)20(1115)24(30)311417532416(17)1226h211H14H21H3(H2829)b1810+
MFCD06782446
N#CC(=Cc1ccc(o1)c1ccc(c(c1)C(=O)OCc1ccccc1C#N)Cl)C(=O)NC
ZINC000009235068
ZINC09235068
ZINC9235068
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