2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-phenethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-phenethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: N-benzyl-2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-phenethyl-acetamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C22H22N2O2S/c25-21(18-27-22-13-7-8-15-24(22)26)23(17-20-11-5-2-6-12-20)16-14-19-9-3-1-4-10-19/h1-13,15H,14,16-18H2