2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-(4-ethanoylphenyl)ethanamide

Systemtic Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-(4-ethanoylphenyl)ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]acetamide Formula: C26H25N4O2S+ MolecularWeight: 457.5673

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C[NH+](CC3)C)C(=C2C#N)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C[NH+](CC3)C)C(=C2C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O2S/c1-17(31)18-8-10-20(11-9-18)28-24(32)16-33-26-21(14-27)25(19-6-4-3-5-7-19)22-15-30(2)13-12-23(22)29-26/h3-11H,12-13,15-16H2,1-2H3,(H,28,32)/p+1