N-[2-(4-tert-butylphenoxy)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C19H24N2O3S MolecularWeight: 360.47046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C19H24N2O3S/c1-19(2,3)15-7-9-16(10-8-15)24-13-11-20-17(22)14-25-18-6-4-5-12-21(18)23/h4-10,12H,11,13-14H2,1-3H3,(H,20,22)