3-[2-(dimethylamino)propylsulfanylmethyl]-N,N-dimethyl-4-oxidanylidene-4-pyridin-3-yl-butanamide

Systemtic Name: 3-[2-(dimethylamino)propylsulfanylmethyl]-N,N-dimethyl-4-oxidanylidene-4-pyridin-3-yl-butanamide Openeye Name: 3-[2-(dimethylamino)propylsulfanylmethyl]-N,N-dimethyl-4-oxo-4-(3-pyridyl)butanamide CAS Name: 3-[[2-(dimethylamino)propylthio]methyl]-N,N-dimethyl-4-oxo-4-(3-pyridinyl)butanamide IUPAC Name: 3-[2-(dimethylamino)propylsulfanylmethyl]-N,N-dimethyl-4-oxo-4-pyridin-3-ylbutanamide Traditional Name: 3-[[2-(dimethylamino)propylthio]methyl]-4-keto-N,N-dimethyl-4-(3-pyridyl)butyramide Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC(CC(=O)N(C)C)C(=O)C1=CN=CC=C1)N(C)C

Isomeric SMILES

CC(CSCC(CC(=O)N(C)C)C(=O)C1=CN=CC=C1)N(C)C

InChI

InChI=1S/C17H27N3O2S/c1-13(19(2)3)11-23-12-15(9-16(21)20(4)5)17(22)14-7-6-8-18-10-14/h6-8,10,13,15H,9,11-12H2,1-5H3