(2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-oxidanylidene-2-(4-propylpyridin-1-ium-1-yl)propanethioamide

Systemtic Name: (2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-oxidanylidene-2-(4-propylpyridin-1-ium-1-yl)propanethioamide Openeye Name: (2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-(4-propylpyridin-1-ium-1-yl)propanethioamide CAS Name: (2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-(4-propyl-1-pyridin-1-iumyl)propanethioamide IUPAC Name: (2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-oxo-2-(4-propylpyridin-1-ium-1-yl)propanethioamide Traditional Name: (2R)-3-(2,4-dichlorophenyl)-N-ethyl-3-keto-2-(4-propylpyridin-1-ium-1-yl)thiopropionamide Formula: C19H21Cl2N2OS+ MolecularWeight: 396.35384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)C(C(=O)C2=C(C=C(C=C2)Cl)Cl)C(=S)NCC

Isomeric SMILES

CCCC1=CC=[N+](C=C1)[C@H](C(=O)C2=C(C=C(C=C2)Cl)Cl)C(=S)NCC

InChI

InChI=1S/C19H20Cl2N2OS/c1-3-5-13-8-10-23(11-9-13)17(19(25)22-4-2)18(24)15-7-6-14(20)12-16(15)21/h6-12,17H,3-5H2,1-2H3/p+1/t17-/m1/s1