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

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-phenethyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenethyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-phenethyl-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-phenethyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-phenethyl-N-(2-thenyl)acetamide Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CS2)C(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CS2)C(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C20H20N2O2S2/c23-19(16-26-20-10-4-5-12-22(20)24)21(15-18-9-6-14-25-18)13-11-17-7-2-1-3-8-17/h1-10,12,14H,11,13,15-16H2