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

Systemtic Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]-N-phenylacetamide IUPAC Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)sulfanyl]-N-phenylacetamide Traditional Name: 2-[(3-cyano-6-methyl-4-phenyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-yl)thio]-N-phenyl-acetamide Formula: C24H23N4OS+ MolecularWeight: 415.53062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4OS/c1-28-13-12-21-20(15-28)23(17-8-4-2-5-9-17)19(14-25)24(27-21)30-16-22(29)26-18-10-6-3-7-11-18/h2-11H,12-13,15-16H2,1H3,(H,26,29)/p+1