Vitas-M small molecule compound
2-amino-1-(2-chlorophenyl)-4-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STL174361
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)COc1ccc(c(c1)C)[N+](=O)[O-])OC)C(=O)CCC2)c1ccccc1Cl
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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 C31H27ClN4O5 MW 571.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN4O5/c1-18-14-21(11-12-24(18)36(38)39)41-17-20-15-19(10-13-28(20)40-2)29-22(16-33)31(34)35(25-7-4-3-6-23(25)32)26-8-5-9-27(37)30(26)29/h3-4,6-7,10-15,29H,5,8-9,17,34H2,1-2H3InChIKey
MIHNYOPNGXITQH-UHFFFAOYSA-NSynonyms
444927-19-92amino1(2chlorophenyl)4(4methoxy3((3methyl4nitrophenoxy)methyl)phenyl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(2chlorophenyl)4(4methoxy3((3methyl4nitrophenoxy)methyl)phenyl)5oxo4678tetrahydroquinoline3carbonitrile
444927199
CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)C3C(=C(N(C4=C3C(=O)CCC4)C5=CC=CC=C5Cl)N)C#N)OC)(N+)(=O)(O)
InChI=1SC31H27ClN4O5c1181421(111224(18)36(38)39)4117201519(101328(20)402)2922(1633)31(34)35(25743623(25)32)2685927(37)30(26)29h3467101529H5891734H212H3
MFCD02606402
N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)COc1ccc(c(c1)C)(N+)(=O)(O))OC)C(=O)CCC2)c1ccccc1Cl
ZINC000002843559
ZINC000008456036
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