2-phenyl-2-phenylsulfanyl-N-(pyridin-1-ium-4-ylmethyl)ethanamide

Systemtic Name: 2-phenyl-2-phenylsulfanyl-N-(pyridin-1-ium-4-ylmethyl)ethanamide Openeye Name: 2-phenyl-2-phenylsulfanyl-N-(pyridin-1-ium-4-ylmethyl)acetamide CAS Name: 2-phenyl-2-(phenylthio)-N-(4-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-phenyl-2-phenylsulfanyl-N-(pyridin-1-ium-4-ylmethyl)acetamide Traditional Name: 2-phenyl-2-(phenylthio)-N-(pyridin-1-ium-4-ylmethyl)acetamide Formula: C20H19N2OS+ MolecularWeight: 335.44266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NCC2=CC=[NH+]C=C2)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NCC2=CC=[NH+]C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H18N2OS/c23-20(22-15-16-11-13-21-14-12-16)19(17-7-3-1-4-8-17)24-18-9-5-2-6-10-18/h1-14,19H,15H2,(H,22,23)/p+1