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N-Phenyl-2-[1'-(ethoxycarbonyl)ethoxy]-2-[(N-phenyl)carboxamido]-3-methylene-4-cyano-5-amino-2,3-dihydropyrrol
SpectraBase Compound ID AAk3wlalw35
InChI InChI=1S/C24H24N4O4/c1-4-31-22(29)17(3)32-24(23(30)27-18-11-7-5-8-12-18)16(2)20(15-25)21(26)28(24)19-13-9-6-10-14-19/h5-14,17H,2,4,26H2,1,3H3,(H,27,30)
InChIKey LHKYSCPIJBDHTQ-UHFFFAOYSA-N
Mol Weight 432.48 g/mol
Molecular Formula C24H24N4O4
Exact Mass 432.179755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27dgtisq48
Name N-Phenyl-2-[1'-(ethoxycarbonyl)ethoxy]-2-[(N-phenyl)carboxamido]-3-methylene-4-cyano-5-amino-2,3-dihydropyrrol
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Formula C24H24N4O4
InChI InChI=1S/C24H24N4O4/c1-4-31-22(29)17(3)32-24(23(30)27-18-11-7-5-8-12-18)16(2)20(15-25)21(26)28(24)19-13-9-6-10-14-19/h5-14,17H,2,4,26H2,1,3H3,(H,27,30)
InChIKey LHKYSCPIJBDHTQ-UHFFFAOYSA-N
Molecular Weight 432.480 g/mol
SMILES NC=1N(C(C(Nc2ccccc2)=O)(C(C1C#N)=C)OC(C(=O)OCC)C)c1ccccc1
SPLASH splash10-031c-0092000000-5bfde20d0684ca753f06
Source of Spectrum SK-27-2342-5
Synonyms Ethyl 2-{[5-amino-2-(anilinocarbonyl)-4-cyano-3-methylene-1-phenyl-2,3-dihydro-1H-pyrrol-2-yl]oxy}propanoate 2-[[5-amino-2-[anilino(oxo)methyl]-4-cyano-3-methylene-1-phenyl-2-pyrrolyl]oxy]propanoic acid ethyl ester Ethyl 2-[5-amino-4-cyano-3-methylidene-1-phenyl-2-(phenylcarbamoyl)pyrrol-2-yl]oxypropanoate Ethyl 2-[5-amino-4-cyano-3-methylene-1-phenyl-2-(phenylcarbamoyl)pyrrol-2-yl]oxypropanoate Ethyl 2-[5-azanyl-4-cyano-3-methylidene-1-phenyl-2-(phenylcarbamoyl)pyrrol-2-yl]oxypropanoate
Wiley ID 867973