N-(2-methyl-2-morpholin-4-yl-butyl)-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-yl-butyl)-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2-methyl-2-morpholino-butyl)-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-methyl-2-(4-morpholinyl)butyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ylbutyl)-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-methyl-2-morpholino-butyl)-2-(phenylthio)nicotinamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCC(C)(CNC(=O)C1=C(N=CC=C1)SC2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C21H27N3O2S/c1-3-21(2,24-12-14-26-15-13-24)16-23-19(25)18-10-7-11-22-20(18)27-17-8-5-4-6-9-17/h4-11H,3,12-16H2,1-2H3,(H,23,25)