4,5,6-trimethyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: 4,5,6-trimethyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: 4,5,6-trimethyl-2-[(3-morpholinosulfonylphenyl)methylsulfanyl]pyridine-3-carboxamide CAS Name: 4,5,6-trimethyl-2-[[3-(4-morpholinylsulfonyl)phenyl]methylthio]-3-pyridinecarboxamide IUPAC Name: 4,5,6-trimethyl-2-[(3-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: 4,5,6-trimethyl-2-[(3-morpholinosulfonylbenzyl)thio]nicotinamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C20H25N3O4S2/c1-13-14(2)18(19(21)24)20(22-15(13)3)28-12-16-5-4-6-17(11-16)29(25,26)23-7-9-27-10-8-23/h4-6,11H,7-10,12H2,1-3H3,(H2,21,24)