N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Formula: C21H21ClN3OS+ MolecularWeight: 398.92894

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3OS/c1-24(2)17-11-13-25(14-12-17)15-21(26)23-19-5-3-4-6-20(19)27-18-9-7-16(22)8-10-18/h3-14H,15H2,1-2H3/p+1