N-(3-chloranyl-2-methyl-phenyl)-2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(3-cyano-4,6-dimethyl-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(3-cyano-4,6-dimethylpyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(3-cyano-4,6-dimethyl-pyridin-1-ium-2-yl)thio]propionamide Formula: C18H19ClN3OS+ MolecularWeight: 360.88096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1C#N)SC(C)C(=O)NC2=C(C(=CC=C2)Cl)C)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1C#N)SC(C)C(=O)NC2=C(C(=CC=C2)Cl)C)C

InChI

InChI=1S/C18H18ClN3OS/c1-10-8-11(2)21-18(14(10)9-20)24-13(4)17(23)22-16-7-5-6-15(19)12(16)3/h5-8,13H,1-4H3,(H,22,23)/p+1