2-methylsulfanyl-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-phenyl)pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-(2-morpholino-5-morpholinosulfonyl-phenyl)pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[2-(4-morpholinyl)-5-(4-morpholinylsulfonyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-(2-morpholino-5-morpholinosulfonyl-phenyl)nicotinamide Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCOCC4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C21H26N4O5S2/c1-31-21-17(3-2-6-22-21)20(26)23-18-15-16(32(27,28)25-9-13-30-14-10-25)4-5-19(18)24-7-11-29-12-8-24/h2-6,15H,7-14H2,1H3,(H,23,26)