2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-(4-methoxyphenyl)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-methoxyphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]-N-(4-methoxyphenyl)acetamide Formula: C25H25N4O2S+ MolecularWeight: 445.5566

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C1)C(=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)OC)C#N)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCC2=C(C1)C(=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)OC)C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2S/c1-29-13-12-22-21(15-29)24(17-6-4-3-5-7-17)20(14-26)25(28-22)32-16-23(30)27-18-8-10-19(31-2)11-9-18/h3-11H,12-13,15-16H2,1-2H3,(H,27,30)/p+1