Vitas-M small molecule compound

(2E)-2-cyano-3-(4-methoxyphenyl)-N-(2-methyl-5-nitrophenyl)prop-2-enamide

Catalog ID
STK042249
SMILES N#C/C(=C\c1ccc(cc1)OC)/C(=O)Nc1cc(ccc1C)[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 C18H15N3O4 MW 337.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O4/c1-12-3-6-15(21(23)24)10-17(12)20-18(22)14(11-19)9-13-4-7-16(25-2)8-5-13/h3-10H,1-2H3,(H,20,22)/b14-9+
InChIKey
DPCHHHLJRQOCOS-NTEUORMPSA-N
Synonyms
345240-78-0
(2E)2CYANO3(4METHOXYPHENYL)N(2METHYL5NITROPHENYL)PROP2ENAMIDE
(E)2CYANO3(4METHOXYPHENYL)N(2METHYL5NITROPHENYL)PROP2ENAMIDE
345240780
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C(=CC2=CC=C(C=C2)OC)C#N
InChI=1SC18H15N3O4c1123615(21(23)24)1017(12)2018(22)14(1119)9134716(252)8513h310H12H3(H2022)b149+
MFCD03205762
N#CC(=Cc1ccc(cc1)OC)C(=O)Nc1cc(ccc1C)(N+)(=O)(O)
STK042249
ZINC000000566164
ZINC00566164
ZINC566164

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Available files

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