2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-naphthalen-2-yl-ethanamide Openeye Name: 2-(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)sulfanyl-N-(2-naphthyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridin-1-iumyl)thio]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-1-ium-2-yl)sulfanyl-N-naphthalen-2-ylacetamide Traditional Name: 2-[(6-amino-3,5-dicyano-pyridin-1-ium-2-yl)thio]-N-(2-naphthyl)acetamide Formula: C19H14N5OS+ MolecularWeight: 360.41236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)CSC3=C(C=C(C(=[NH+]3)N)C#N)C#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)CSC3=C(C=C(C(=[NH+]3)N)C#N)C#N

InChI

InChI=1S/C19H13N5OS/c20-9-14-7-15(10-21)19(24-18(14)22)26-11-17(25)23-16-6-5-12-3-1-2-4-13(12)8-16/h1-8H,11H2,(H2,22,24)(H,23,25)/p+1