3-chloranyl-2,2-dimethyl-N-[3-methyl-2-(pyridin-2-ylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-chloranyl-2,2-dimethyl-N-[3-methyl-2-(pyridin-2-ylmethylsulfanyl)phenyl]propanamide Openeye Name: 3-chloro-2,2-dimethyl-N-[3-methyl-2-(2-pyridylmethylsulfanyl)phenyl]propanamide CAS Name: 3-chloro-2,2-dimethyl-N-[3-methyl-2-(2-pyridinylmethylthio)phenyl]propanamide IUPAC Name: 3-chloro-2,2-dimethyl-N-[3-methyl-2-(pyridin-2-ylmethylsulfanyl)phenyl]propanamide Traditional Name: 3-chloro-2,2-dimethyl-N-[3-methyl-2-(2-pyridylmethylthio)phenyl]propionamide Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(C)(C)CCl)SCC2=CC=CC=N2

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C(C)(C)CCl)SCC2=CC=CC=N2

InChI

InChI=1S/C18H21ClN2OS/c1-13-7-6-9-15(21-17(22)18(2,3)12-19)16(13)23-11-14-8-4-5-10-20-14/h4-10H,11-12H2,1-3H3,(H,21,22)