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5-cyano-6-(ethylthio)-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
SpectraBase Compound ID Aw5xQzUhgFb
InChI InChI=1S/C22H21N3O2S/c1-3-28-22-18(13-23)20(15-9-11-17(26)12-10-15)19(14(2)24-22)21(27)25-16-7-5-4-6-8-16/h4-12,20,24,26H,3H2,1-2H3,(H,25,27)
InChIKey VXHPHFRYLYKAEY-UHFFFAOYSA-N
Mol Weight 391.49 g/mol
Molecular Formula C22H21N3O2S
Exact Mass 391.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYxVd6qwGgJ
Name 5-cyano-6-(ethylthio)-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Alternate Name(s) 5-cyano-6-ethylsulfanyl-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N3O2S
InChI InChI=1S/C22H21N3O2S/c1-3-28-22-18(13-23)20(15-9-11-17(26)12-10-15)19(14(2)24-22)21(27)25-16-7-5-4-6-8-16/h4-12,20,24,26H,3H2,1-2H3,(H,25,27)
InChIKey VXHPHFRYLYKAEY-UHFFFAOYSA-N
Molecular Weight 391.489 g/mol
SMILES N1C(=C(C(c2ccc(cc2)O)C(C#N)=C1SCC)C(Nc1ccccc1)=O)C
SPLASH splash10-00r5-6593000000-5ca5976b0ede68f95088
Wiley ID 1453605