5-[(5-ethynylthiophen-2-yl)carbonylamino]-N-[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-2-oxidanylidene-1,3-dioxane-5-carboxamide

Systemtic Name: 5-[(5-ethynylthiophen-2-yl)carbonylamino]-N-[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-2-oxidanylidene-1,3-dioxane-5-carboxamide Openeye Name: 5-[(5-ethynylthiophene-2-carbonyl)amino]-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-oxo-1,3-dioxane-5-carboxamide CAS Name: 5-[[(5-ethynyl-2-thiophenyl)-oxomethyl]amino]-N-[3-methyl-4-(3-oxo-4-morpholinyl)phenyl]-2-oxo-1,3-dioxane-5-carboxamide IUPAC Name: 5-[(5-ethynylthiophene-2-carbonyl)amino]-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-oxo-1,3-dioxane-5-carboxamide Traditional Name: 5-[(5-ethynylthiophene-2-carbonyl)amino]-2-keto-N-[4-(3-ketomorpholino)-3-methyl-phenyl]-1,3-dioxane-5-carboxamide Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2(COC(=O)OC2)NC(=O)C3=CC=C(S3)C#C)N4CCOCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2(COC(=O)OC2)NC(=O)C3=CC=C(S3)C#C)N4CCOCC4=O

InChI

InChI=1S/C23H21N3O7S/c1-3-16-5-7-18(34-16)20(28)25-23(12-32-22(30)33-13-23)21(29)24-15-4-6-17(14(2)10-15)26-8-9-31-11-19(26)27/h1,4-7,10H,8-9,11-13H2,2H3,(H,24,29)(H,25,28)