N-(4-methyl-3-nitro-phenyl)-2-(3-oxidanylidenethiomorpholin-2-yl)ethanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-(3-oxidanylidenethiomorpholin-2-yl)ethanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-2-(3-oxothiomorpholin-2-yl)acetamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-(3-oxo-2-thiomorpholinyl)acetamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide Traditional Name: 2-(3-ketothiomorpholin-2-yl)-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2C(=O)NCCS2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2C(=O)NCCS2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c1-8-2-3-9(6-10(8)16(19)20)15-12(17)7-11-13(18)14-4-5-21-11/h2-3,6,11H,4-5,7H2,1H3,(H,14,18)(H,15,17)