2-(4-chlorophenyl)sulfanyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]propanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]propanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(dimethylamino)-3-pyridyl]methyl]propanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[2-(dimethylamino)-3-pyridinyl]methyl]propanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]propanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[[2-(dimethylamino)-3-pyridyl]methyl]propionamide Formula: C17H20ClN3OS MolecularWeight: 349.8782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=C(N=CC=C1)N(C)C)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NCC1=C(N=CC=C1)N(C)C)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClN3OS/c1-12(23-15-8-6-14(18)7-9-15)17(22)20-11-13-5-4-10-19-16(13)21(2)3/h4-10,12H,11H2,1-3H3,(H,20,22)