Vitas-M small molecule compound
ethyl 4-(5-{(1E)-2-cyano-3-oxo-3-[(pyridin-3-ylmethyl)amino]prop-1-en-1-yl}furan-2-yl)benzoate
Catalog ID
STK401602
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(/C(=O)NCc1cccnc1)\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 C23H19N3O4 MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4/c1-2-29-23(28)18-7-5-17(6-8-18)21-10-9-20(30-21)12-19(13-24)22(27)26-15-16-4-3-11-25-14-16/h3-12,14H,2,15H2,1H3,(H,26,27)/b19-12+InChIKey
RYHFLKBVZFXAHP-XDHOZWIPSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NCC3=CN=CC=C3
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C(C(=O)NCc1cccnc1)C#N
ethyl4(5((1E)2cyano3oxo3((pyridin3ylmethyl)amino)prop1en1yl)furan2yl)benzoate
ethyl4(5((E)2cyano3oxo3(pyridin3ylmethylamino)prop1enyl)furan2yl)benzoate
InChI=1SC23H19N3O4c122923(28)187517(6818)2110920(3021)1219(1324)22(27)2615164311251416h31214H215H21H3(H2627)b1912+
MFCD07063593
ZINC000017082166
ZINC17082166
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