Vitas-M small molecule compound

(2E)-2-cyano-3-[2-(naphthalen-1-ylmethoxy)phenyl]-N-[4-nitro-2-(trifluoromethyl)phenyl]prop-2-enamide

Catalog ID
STL382787
SMILES N#C/C(=C\c1ccccc1OCc1cccc2c1cccc2)/C(=O)Nc1ccc(cc1C(F)(F)F)[N+](=O)[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 C28H18F3N3O4 MW 517.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H18F3N3O4/c29-28(30,31)24-15-22(34(36)37)12-13-25(24)33-27(35)21(16-32)14-19-7-2-4-11-26(19)38-17-20-9-5-8-18-6-1-3-10-23(18)20/h1-15H,17H2,(H,33,35)/b21-14+
InChIKey
UKTXMEIUOFNJBK-KGENOOAVSA-N
Synonyms

(2E)2cyano3(2(naphthalen1ylmethoxy)phenyl)N(4nitro2(trifluoromethyl)phenyl)prop2enamide
(E)2cyano3(2(naphthalen1ylmethoxy)phenyl)N(4nitro2(trifluoromethyl)phenyl)prop2enamide
C1=CC=C2C(=C1)C=CC=C2COC3=CC=CC=C3C=C(C#N)C(=O)NC4=C(C=C(C=C4)(N+)(=O)(O))C(F)(F)F
InChI=1SC28H18F3N3O4c2928(3031)241522(34(36)37)121325(24)3327(35)21(1632)14197241126(19)381720958186131023(18)20h115H17H2(H3335)b2114+
MFCD02731785
N#CC(=Cc1ccccc1OCc1cccc2c1cccc2)C(=O)Nc1ccc(cc1C(F)(F)F)(N+)(=O)(O)
ZINC000033517240
ZINC33517240

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Available files

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