Vitas-M small molecule compound
2-amino-4-{3-bromo-4-[(4-nitrobenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL419277
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)Br)OCc1ccc(cc1)[N+](=O)[O-])C(=O)CCC2
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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 C23H18BrN3O5 MW 496.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O5/c24-17-10-14(6-9-19(17)31-12-13-4-7-15(8-5-13)27(29)30)21-16(11-25)23(26)32-20-3-1-2-18(28)22(20)21/h4-10,21H,1-3,12,26H2InChIKey
HKSMJAVXWFBRRR-UHFFFAOYSA-NSynonyms
2amino4(3bromo4((4nitrobenzyl)oxy)phenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(3bromo4((4nitrophenyl)methoxy)phenyl)5oxo4678tetrahydrochromene3carbonitrile
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)(N+)(=O)(O))Br)C(=O)C1
InChI=1SC23H18BrN3O5c24171014(6919(17)3112134715(8513)27(29)30)2116(1125)23(26)322031218(28)22(20)21h41021H131226H2
MFCD04210087
N#CC1=C(N)OC2=C(C1c1ccc(c(c1)Br)OCc1ccc(cc1)(N+)(=O)(O))C(=O)CCC2
ZINC000001119136
ZINC000001119139
Check stock
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