Vitas-M small molecule compound
2-amino-1-(2,6-difluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK768759
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2)c1c(F)cccc1F
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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 C23H19F2N3O3 MW 423.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19F2N3O3/c1-31-19-10-12(8-9-17(19)29)20-13(11-26)23(27)28(16-6-3-7-18(30)21(16)20)22-14(24)4-2-5-15(22)25/h2,4-5,8-10,20,29H,3,6-7,27H2,1H3InChIKey
PCERPFWWUSSEHM-UHFFFAOYSA-NSynonyms
2amino1(26difluorophenyl)4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(26difluorophenyl)4(4hydroxy3methoxyphenyl)5oxo4678tetrahydroquinoline3carbonitrile
COC1=C(C=CC(=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(C=CC=C4F)F)N)C#N)O
InChI=1SC23H19F2N3O3c131191012(8917(19)29)2013(1126)23(27)28(1663718(30)21(16)20)2214(24)42515(22)25h2458102029H36727H21H3
MFCD03307953
ZINC000000720226
ZINC000000720227
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