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5-cyano-2-phenyl-6-(propylthio)-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester
SpectraBase Compound ID FygTHVGpqkE
InChI InChI=1S/C23H23N3O2S/c1-3-13-29-22-18(14-24)19(17-11-8-12-25-15-17)20(23(27)28-4-2)21(26-22)16-9-6-5-7-10-16/h5-12,15,19,26H,3-4,13H2,1-2H3
InChIKey KSLIBBHFZJYHCI-UHFFFAOYSA-N
Mol Weight 405.52 g/mol
Molecular Formula C23H23N3O2S
Exact Mass 405.151098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALMLkAEk190
Name 5-cyano-2-phenyl-6-(propylthio)-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester
Alternate Name(s) 5-cyano-2-phenyl-6-(propylthio)-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Ethyl 5-cyano-2-phenyl-6-propylsulfanyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylate
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Formula C23H23N3O2S
InChI InChI=1S/C23H23N3O2S/c1-3-13-29-22-18(14-24)19(17-11-8-12-25-15-17)20(23(27)28-4-2)21(26-22)16-9-6-5-7-10-16/h5-12,15,19,26H,3-4,13H2,1-2H3
InChIKey KSLIBBHFZJYHCI-UHFFFAOYSA-N
Molecular Weight 405.516 g/mol
SMILES N1C(=C(C(C(=C1c1ccccc1)C(=O)OCC)c1cnccc1)C#N)SCCC
SPLASH splash10-004i-1269100000-024e81a011fc5791242c
Wiley ID 1462748