N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-tert-amylphenoxy)phenyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C24H26N2O3S/c1-4-24(2,3)18-8-12-20(13-9-18)29-21-14-10-19(11-15-21)25-22(27)17-30-23-7-5-6-16-26(23)28/h5-16H,4,17H2,1-3H3,(H,25,27)