Vitas-M small molecule compound

N-[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]-4-(morpholin-4-yl)-3-nitrobenzamide

Catalog ID
STK398939
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)Nc1ccc(c(c1)Cl)c1cc2ccccc2oc1=O

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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 C26H20ClN3O6 MW 505.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O6/c27-21-15-18(6-7-19(21)20-13-16-3-1-2-4-24(16)36-26(20)32)28-25(31)17-5-8-22(23(14-17)30(33)34)29-9-11-35-12-10-29/h1-8,13-15H,9-12H2,(H,28,31)
InChIKey
RZMCOCHVNHJEDC-UHFFFAOYSA-N
Synonyms

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl)(N+)(=O)(O)
InChI=1SC26H20ClN3O6c27211518(6719(21)201316312424(16)3626(20)32)2825(31)175822(23(1417)30(33)34)2991135121029h181315H912H2(H2831)
MFCD08127912
N(3chloro4(2oxo2Hchromen3yl)phenyl)4(morpholin4yl)3nitrobenzamide
N(3chloro4(2oxochromen3yl)phenyl)4morpholin4yl3nitrobenzamide
O=C(c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1)Nc1ccc(c(c1)Cl)c1cc2ccccc2oc1=O
ZINC000008901234
ZINC08901234
ZINC8901234

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Available files

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