N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetamide Formula: C21H24N3O2S+ MolecularWeight: 382.49916

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC=C1C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SCC(=O)N

Isomeric SMILES

C1C[NH+](CC=C1C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C21H23N3O2S/c22-20(25)15-27-19-9-5-4-8-18(19)23-21(26)14-24-12-10-17(11-13-24)16-6-2-1-3-7-16/h1-10H,11-15H2,(H2,22,25)(H,23,26)/p+1