2-[[5-cyano-3-ethanoyl-2-methyl-4-(3-nitrophenyl)-2-oxidanyl-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-cyano-3-ethanoyl-2-methyl-4-(3-nitrophenyl)-2-oxidanyl-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]ethanamide Openeye Name: 2-[[3-acetyl-5-cyano-2-hydroxy-2-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide CAS Name: 2-[[3-acetyl-5-cyano-2-hydroxy-2-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridin-6-yl]thio]acetamide IUPAC Name: 2-[[3-acetyl-5-cyano-2-hydroxy-2-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide Traditional Name: 2-[[3-acetyl-5-cyano-2-hydroxy-2-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyridin-6-yl]thio]acetamide Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(=C(NC1(C)O)SCC(=O)N)C#N)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1C(C(=C(NC1(C)O)SCC(=O)N)C#N)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S/c1-9(22)15-14(10-4-3-5-11(6-10)21(25)26)12(7-18)16(20-17(15,2)24)27-8-13(19)23/h3-6,14-15,20,24H,8H2,1-2H3,(H2,19,23)