(E)-[azanyl(sulfanyl)methylidene]-(5-ethanoyl-3-ethoxycarbonyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-methyl-azanium

Systemtic Name: (E)-[azanyl(sulfanyl)methylidene]-(5-ethanoyl-3-ethoxycarbonyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-methyl-azanium Openeye Name: (E)-(5-acetyl-3-ethoxycarbonyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-[amino(sulfanyl)methylene]-methyl-ammonium CAS Name: (E)-(5-acetyl-3-ethoxycarbonyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-[amino(mercapto)methylidene]-methylammonium IUPAC Name: (E)-(5-acetyl-3-ethoxycarbonyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-[amino(sulfanyl)methylidene]-methylazanium Traditional Name: (E)-(5-acetyl-3-carbethoxy-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)-[amino(mercapto)methylene]-methyl-ammonium Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2)C(=O)C)C)[N+](=C(N)S)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2)C(=O)C)C)/[N+](=C(\N)/S)/C

InChI

InChI=1S/C19H23N3O3S/c1-5-25-18(24)16-15(13-9-7-6-8-10-13)14(12(3)23)11(2)21-17(16)22(4)19(20)26/h6-10,15H,5H2,1-4H3,(H3,20,21,23,24,26)/p+1