2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-[(6-morpholino-3-pyridyl)methyl]benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]benzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-[(6-morpholino-3-pyridyl)methyl]benzamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCC2=CN=C(C=C2)N3CCOCC3

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NCC2=CN=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H26N4O3S/c1-24(2)20(26)15-29-18-6-4-3-5-17(18)21(27)23-14-16-7-8-19(22-13-16)25-9-11-28-12-10-25/h3-8,13H,9-12,14-15H2,1-2H3,(H,23,27)