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

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-2-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-2-(p-tolylsulfanyl)propanamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-[(4-methylphenyl)thio]propanamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-2-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-2-(p-tolylthio)propionamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=C(N=CC=C2)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(C)C(=O)NCC2=C(N=CC=C2)N(C)C

InChI

InChI=1S/C18H23N3OS/c1-13-7-9-16(10-8-13)23-14(2)18(22)20-12-15-6-5-11-19-17(15)21(3)4/h5-11,14H,12H2,1-4H3,(H,20,22)