N-[2,5-bis(chloranyl)phenyl]-3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: 3-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(2,5-dichlorophenyl)propanamide CAS Name: 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-(2,5-dichlorophenyl)propanamide IUPAC Name: 3-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(2,5-dichlorophenyl)propanamide Traditional Name: 3-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(2,5-dichlorophenyl)propionamide Formula: C17H15Cl2N3OS MolecularWeight: 380.2915

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCCC(=O)NC2=C(C=CC(=C2)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCCC(=O)NC2=C(C=CC(=C2)Cl)Cl)C

InChI

InChI=1S/C17H15Cl2N3OS/c1-10-7-11(2)21-17(13(10)9-20)24-6-5-16(23)22-15-8-12(18)3-4-14(15)19/h3-4,7-8H,5-6H2,1-2H3,(H,22,23)